,feature_id,component_id,structure_taxonomy_npclassifier_01pathway_consensus,structure_taxonomy_npclassifier_02superclass_consensus,structure_taxonomy_npclassifier_03class_consensus,msms_score,libname,structure_inchikey,structure_inchi,structure_smiles,structure_molecular_formula,adduct,structure_exact_mass,short_inchikey,structure_taxonomy_npclassifier_01pathway,structure_taxonomy_npclassifier_02superclass,structure_taxonomy_npclassifier_03class,organism_name,organism_taxonomy_ottid,organism_taxonomy_01domain,organism_taxonomy_02kingdom,organism_taxonomy_03phylum,organism_taxonomy_04class,organism_taxonomy_05order,organism_taxonomy_06family,organism_taxonomy_07tribe,organism_taxonomy_08genus,organism_taxonomy_09species,score_taxo,score_max_consistency,final_score 0,7423,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,FKARAOWYAAUAFW-MGRBCSRPSA-N,"InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20+,21-,24-,25+,26-,27-,28+/m1/s1",Cc1c(O)c(O)cc2c1CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H40O4,pos_2_2proton,440.29265976,FKARAOWYAAUAFW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,1,6.5 1,7423,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,FKARAOWYAAUAFW-MGRBCSRPSA-N,"InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20+,21-,24-,25+,26-,27-,28+/m1/s1",Cc1c(O)c(O)cc2c1CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H40O4,pos_2_2proton,440.29265976,FKARAOWYAAUAFW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,1,6.5 2,7422,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3,7422,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 4,7422,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 5,7422,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 6,7422,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,3,7.5 7,7422,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8,7421,-1,,,,0.4102572,ISDB,NSOQQZAUFCNZHQ-GWGOZDFZSA-N,"InChI=1S/C23H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(27)22(20-25)24-21(2)26/h18-19,22-23,25,27H,3-17,20H2,1-2H3,(H,24,26)/b19-18+/t22-,23+/m1/s1",CCCCCCCCCCCCCCCC/C=C/[C@H](O)[C@@H](CO)NC(C)=O,C23H45NO3,,383.3399443,NSOQQZAUFCNZHQ,Fatty acids,Sphingolipids,Ceramides,Tanacetum sinaicum,7050869.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Tanacetum'],['Tanacetum sinaicum'],4,0,5.6410287618637085 9,7421,-1,,,,0.4102572,ISDB,NSOQQZAUFCNZHQ-GWGOZDFZSA-N,"InChI=1S/C23H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(27)22(20-25)24-21(2)26/h18-19,22-23,25,27H,3-17,20H2,1-2H3,(H,24,26)/b19-18+/t22-,23+/m1/s1",CCCCCCCCCCCCCCCC/C=C/[C@H](O)[C@@H](CO)NC(C)=O,C23H45NO3,,383.3399443,NSOQQZAUFCNZHQ,Fatty acids,Sphingolipids,Ceramides,Tanacetum artemisioides,7596067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Tanacetum'],['Tanacetum artemisioides'],4,0,5.6410287618637085 10,7420,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.53851944,ISDB,OFAYIAUICPXDBC-QPSCCSFWSA-N,"InChI=1S/C15H24O/c1-10(2)12-5-6-15(4)9-13(16)7-11(3)14(15)8-12/h12-14,16H,1,3,5-9H2,2,4H3/t12-,13+,14+,15+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)CC(=C)[C@@H]2C1,C15H24O,,220.182715388,OFAYIAUICPXDBC,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,9.654077768325806 11,7418,1370,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QFEWDYKEKVVRHZ-QVKHUSFCSA-N,"InChI=1S/C35H48N2O10/c1-7-37-16-32(17-46-30(40)20-10-8-9-11-23(20)36-18(2)38)13-12-25(44-5)34-22-14-21-24(43-4)15-33(41,26(22)27(21)47-19(3)39)35(42,31(34)37)29(45-6)28(32)34/h8-11,21-22,24-29,31,41-42H,7,12-17H2,1-6H3,(H,36,38)/t21-,22-,24+,25+,26-,27+,28-,29+,31+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C35H48N2O10,pos_2_2sodium,656.330895736,QFEWDYKEKVVRHZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,7.5 12,7418,1370,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QFEWDYKEKVVRHZ-QVKHUSFCSA-N,"InChI=1S/C35H48N2O10/c1-7-37-16-32(17-46-30(40)20-10-8-9-11-23(20)36-18(2)38)13-12-25(44-5)34-22-14-21-24(43-4)15-33(41,26(22)27(21)47-19(3)39)35(42,31(34)37)29(45-6)28(32)34/h8-11,21-22,24-29,31,41-42H,7,12-17H2,1-6H3,(H,36,38)/t21-,22-,24+,25+,26-,27+,28-,29+,31+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C35H48N2O10,pos_2_2sodium,656.330895736,QFEWDYKEKVVRHZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,7.5 13,7418,1370,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QFEWDYKEKVVRHZ-QVKHUSFCSA-N,"InChI=1S/C35H48N2O10/c1-7-37-16-32(17-46-30(40)20-10-8-9-11-23(20)36-18(2)38)13-12-25(44-5)34-22-14-21-24(43-4)15-33(41,26(22)27(21)47-19(3)39)35(42,31(34)37)29(45-6)28(32)34/h8-11,21-22,24-29,31,41-42H,7,12-17H2,1-6H3,(H,36,38)/t21-,22-,24+,25+,26-,27+,28-,29+,31+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C35H48N2O10,pos_2_2sodium,656.330895736,QFEWDYKEKVVRHZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,3,7.5 14,7418,1370,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QFEWDYKEKVVRHZ-QVKHUSFCSA-N,"InChI=1S/C35H48N2O10/c1-7-37-16-32(17-46-30(40)20-10-8-9-11-23(20)36-18(2)38)13-12-25(44-5)34-22-14-21-24(43-4)15-33(41,26(22)27(21)47-19(3)39)35(42,31(34)37)29(45-6)28(32)34/h8-11,21-22,24-29,31,41-42H,7,12-17H2,1-6H3,(H,36,38)/t21-,22-,24+,25+,26-,27+,28-,29+,31+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C35H48N2O10,pos_2_2sodium,656.330895736,QFEWDYKEKVVRHZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,3,7.5 15,7418,1370,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QFEWDYKEKVVRHZ-QVKHUSFCSA-N,"InChI=1S/C35H48N2O10/c1-7-37-16-32(17-46-30(40)20-10-8-9-11-23(20)36-18(2)38)13-12-25(44-5)34-22-14-21-24(43-4)15-33(41,26(22)27(21)47-19(3)39)35(42,31(34)37)29(45-6)28(32)34/h8-11,21-22,24-29,31,41-42H,7,12-17H2,1-6H3,(H,36,38)/t21-,22-,24+,25+,26-,27+,28-,29+,31+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C35H48N2O10,pos_2_2sodium,656.330895736,QFEWDYKEKVVRHZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,3,7.5 16,7417,476,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1proton,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 17,7409,741,Terpenoids,Tryptophan alkaloids,Quinoline alkaloids,0.24727815,ISDB,IJGDGRMCHJUXEN-UHFFFAOYSA-N,"InChI=1S/C20H29NO3/c1-5-6-7-8-9-10-11-15-12-13-16(23-3)18-17(15)19(22)20(24-4)14(2)21-18/h12-13H,5-11H2,1-4H3,(H,21,22)",CCCCCCCCc1ccc(OC)c2[nH]c(C)c(OC)c(=O)c12,C20H29NO3,,331.214743788,IJGDGRMCHJUXEN,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Waltheria indica,1039214.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Waltheria'],['Waltheria indica'],4,3,6.489112615585327 18,7408,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.7919946,ISDB,ZCCLDKGWJIREQF-PDBXOOCHSA-N,"InChI=1S/C21H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h3-4,6-7,9-10,20,22-23H,2,5,8,11-19H2,1H3/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO,C21H36O4,,352.261359632,ZCCLDKGWJIREQF,Fatty acids,Glycerolipids,Monoacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,3,8.667978286743164 19,7407,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,IACGCNCKRUFSAK-BKJBWSIDSA-N,"InChI=1S/C22H30O13/c1-9-15(25)17(27)19(29)21(33-9)32-8-13-16(26)18(28)20(30)22(34-13)35-14(24)6-4-10-3-5-11(23)12(7-10)31-2/h3-7,9,13,15-23,25-30H,8H2,1-2H3/b6-4+/t9-,13+,15-,16+,17+,18-,19+,20+,21+,22-/m0/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C22H30O13,pos_1_1proton1acetonitrile,502.16864102,IACGCNCKRUFSAK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,3,9.5 20,7404,-1,,,,0.0,MS1_match,SFJFCIDQFBVZLY-UHFFFAOYSA-N,"InChI=1S/C20H34O2/c1-17(2)8-4-9-20(13-21)15(17)7-10-19-11-14(5-6-16(19)20)18(3,22)12-19/h14-16,21-22H,4-13H2,1-3H3",CC1(C)CCCC2(CO)C1CCC13CC(CCC12)C(C)(O)C3,C20H34O2,pos_1_minus1proton2sodium,306.255880328,SFJFCIDQFBVZLY,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum coreanum,377294.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum coreanum'],6,0,6.0 21,7401,395,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.24371113,ISDB,OEBUJDRTQIBBBJ-GJZGRUSLSA-N,"InChI=1S/C17H28O6/c1-12(9-13(2)10-16(20)21)7-5-3-4-6-8-15(19)14(11-18)17(22)23/h9-10,14-15,18-19H,3-8,11H2,1-2H3,(H,20,21)(H,22,23)/t14-,15-/m0/s1",CC(=CC(=O)O)C=C(C)CCCCCC[C@H](O)[C@H](CO)C(=O)O,C17H28O6,,328.188588616,OEBUJDRTQIBBBJ,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Fusarium solani,137469.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Nectriaceae'],['Unknown'],['Fusarium'],['Fusarium solani'],1,3,3.474844515323639 22,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 23,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 24,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 25,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 26,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 27,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 28,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 29,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 30,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 31,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 32,7399,423,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 33,7397,-1,,,,0.0,MS1_match,XIUVHOSBSDYXRG-UVTAEQIVSA-N,"InChI=1S/C22H28O11/c1-22(2,28)15-5-10-12(32-15)6-13-16(20(10)29-3)11(24)4-9(31-13)8-30-21-19(27)18(26)17(25)14(7-23)33-21/h4,6,14-15,17-19,21,23,25-28H,5,7-8H2,1-3H3/t14-,15+,17-,18+,19-,21-/m1/s1",COc1c2c(cc3oc(CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(=O)c13)O[C@H](C(C)(C)O)C2,C22H28O11,pos_1_1proton1methanol,468.16316171599976,XIUVHOSBSDYXRG,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 34,7396,-1,,,,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1sodium1acetonitrile,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 35,7396,-1,,,,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1sodium1acetonitrile,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 36,7392,-1,,,,0.0,MS1_match,UTUISHMYVAZILQ-UHFFFAOYSA-N,"InChI=1S/C30H26O12/c31-14-24-29(42-25(36)10-3-15-1-6-17(32)7-2-15)27(37)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2",O=C(C=Cc1ccc(O)cc1)OC1C(CO)OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)C(O)C1O,C30H26O12,pos_1_sodium,578.142426272,UTUISHMYVAZILQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 37,7392,-1,,,,0.0,MS1_match,ZTDLEPCPWDWZOM-IOQDTQQCSA-N,"InChI=1S/C30H26O12/c31-16-6-1-14(2-7-16)3-10-23(35)40-13-22-26(36)28(38)29(39)30(42-22)25-19(34)12-21-24(27(25)37)18(33)11-20(41-21)15-4-8-17(32)9-5-15/h1-12,22,26,28-32,34,36-39H,13H2/b10-3+/t22-,26-,28+,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](c2c(O)cc3oc(-c4ccc(O)cc4)cc(=O)c3c2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O12,pos_1_sodium,578.142426272,ZTDLEPCPWDWZOM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 38,7386,-1,,,,0.0,MS1_match,YHPFWEDUGHFFTA-UHFFFAOYSA-N,"InChI=1S/C24H32O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,14,16,18-20,27H,4-5,7-13H2,1-2H3",CC12CCC(=O)CC1CCC1C2CCC2(C)C(c3ccc(=O)oc3)CCC12O,C24H32O4,pos_1_1proton1acetonitrile,384.230059504,YHPFWEDUGHFFTA,Terpenoids,Steroids,Bufadienolides,Helleborus odorus,648059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus odorus'],6,0,6.0 39,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nemorum,44343.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nemorum'],6,3,7.5 40,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-QKNOXMJZSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13?,14?,15?,16-,17?,18?,19?,20?,21?,22-,23-,24?/m0/s1",CCN1C[C@]2(COC)CCC(OC)C34C5CC6C(O)C5[C@](O)(C[C@@H]6OC)C(CC32)C14,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,3,7.5 41,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-NPNNQAKASA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1C(C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tanguticum,1088652.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tanguticum'],6,3,7.5 42,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongoricum,6131511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongoricum'],6,3,7.5 43,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nagarum,488235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nagarum'],6,3,7.5 44,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 45,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 46,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,3,7.5 47,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,3,7.5 48,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,7.5 49,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum legendrei,44349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum legendrei'],6,3,7.5 50,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,3,7.5 51,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 52,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,3,7.5 53,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,3,7.5 54,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,3,7.5 55,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,3,7.5 56,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,3,7.5 57,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum dolichorhynchum,6131378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum dolichorhynchum'],6,3,7.5 58,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 59,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 60,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 61,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,FEOORLCKDHTOCS-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(27,16(13)18(12)26)17(21(24)25)19(30-5)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,FEOORLCKDHTOCS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium roylei,6131791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium roylei'],6,3,7.5 62,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 63,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-YXQJRNGSSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19-,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,3,7.5 64,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium virgatum,885406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium virgatum'],6,3,7.5 65,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-DPMVDKOOSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15-,16-,17-,18-,19-,20+,21+,22-,23-,24-/m1/s1",CCN1C[C@@]2(C)CC[C@@H](OC)[C@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@H]([C@@H](O)[C@@H]23)[C@H]14,C24H39NO5,pos_1_1proton,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium favargeri,209870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium favargeri'],6,3,7.5 66,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,3,7.5 67,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 68,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-YXQJRNGSSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19-,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,3,7.5 69,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium virgatum,885406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium virgatum'],6,3,7.5 70,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-DPMVDKOOSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15-,16-,17-,18-,19-,20+,21+,22-,23-,24-/m1/s1",CCN1C[C@@]2(C)CC[C@@H](OC)[C@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@H]([C@@H](O)[C@@H]23)[C@H]14,C24H39NO5,pos_1_1proton,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium favargeri,209870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium favargeri'],6,3,7.5 71,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,3,7.5 72,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sczukinii,7049059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sczukinii'],6,3,7.5 73,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,3,7.5 74,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,3,7.5 75,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum macrorhynchum,7591226.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum macrorhynchum'],6,3,7.5 76,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,3,7.5 77,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum seravschanicum,395973.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum seravschanicum'],6,3,7.5 78,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudostapfianum,1073593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tuguancunense'],6,3,7.5 79,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,3,7.5 80,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,3,7.5 81,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 82,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,7.5 83,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sanyoense,675791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sanyoense'],6,3,7.5 84,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,3,7.5 85,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,7.5 86,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,QYUGOUBBYKWQFZ-OPOJCKMMSA-N,"InChI=1S/C23H35NO4/c1-4-24-11-21(12-27-2)7-6-17(28-3)23-14-9-13-5-8-22(26,18(14)19(13)25)15(20(23)24)10-16(21)23/h5,8,13-20,25-26H,4,6-7,9-12H2,1-3H3/t13-,14+,15-,16+,17-,18+,19-,20+,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@@H]6C=C[C@@](O)([C@H]5[C@H]6O)[C@@H](C[C@H]23)[C@@H]14,C23H35NO4,pos_1_1proton1methanol,389.2566086,QYUGOUBBYKWQFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum liljestrandii,556434.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum liljestrandii'],6,3,7.5 87,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum legendrei,44349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum legendrei'],6,3,7.5 88,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,3,7.5 89,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 90,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,3,7.5 91,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,3,7.5 92,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,3,7.5 93,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,3,7.5 94,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,3,7.5 95,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,3,7.5 96,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 97,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,7.5 98,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sanyoense,675791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sanyoense'],6,3,7.5 99,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 100,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 101,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum dolichorhynchum,6131378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum dolichorhynchum'],6,3,7.5 102,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongoricum,6131511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongoricum'],6,3,7.5 103,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sczukinii,7049059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sczukinii'],6,3,7.5 104,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,3,7.5 105,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,3,7.5 106,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nagarum,488235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nagarum'],6,3,7.5 107,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,3,7.5 108,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum seravschanicum,395973.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum seravschanicum'],6,3,7.5 109,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudostapfianum,1073593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tuguancunense'],6,3,7.5 110,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum macrorhynchum,7591226.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum macrorhynchum'],6,3,7.5 111,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 112,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,3,7.5 113,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-NPNNQAKASA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1C(C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tanguticum,1088652.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tanguticum'],6,3,7.5 114,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-QKNOXMJZSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13?,14?,15?,16-,17?,18?,19?,20?,21?,22-,23-,24?/m0/s1",CCN1C[C@]2(COC)CCC(OC)C34C5CC6C(O)C5[C@](O)(C[C@@H]6OC)C(CC32)C14,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,3,7.5 115,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,3,7.5 116,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 117,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 118,7385,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nemorum,44343.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nemorum'],6,3,7.5 119,7384,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,ZVIQIPQKRVKNLN-GZMMTYOYSA-N,"InChI=1S/C12H16O7/c13-5-8(14)6-19-12(18)11(17)4-7-1-2-9(15)10(16)3-7/h1-3,8,11,13-17H,4-6H2/t8-,11+/m0/s1",O=C(OC[C@@H](O)CO)[C@H](O)Cc1ccc(O)c(O)c1,C12H16O7,pos_1_1potassium,272.089602852,ZVIQIPQKRVKNLN,Shikimates and Phenylpropanoids,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 120,7384,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,ZVIQIPQKRVKNLN-GZMMTYOYSA-N,"InChI=1S/C12H16O7/c13-5-8(14)6-19-12(18)11(17)4-7-1-2-9(15)10(16)3-7/h1-3,8,11,13-17H,4-6H2/t8-,11+/m0/s1",O=C(OC[C@@H](O)CO)[C@H](O)Cc1ccc(O)c(O)c1,C12H16O7,pos_1_1potassium,272.089602852,ZVIQIPQKRVKNLN,Shikimates and Phenylpropanoids,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 121,7382,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.7319181,ISDB,RRUFTPKJXNXMAE-UHFFFAOYSA-N,"InChI=1S/C14H16O2/c1-5-10-8-11-6-7-14(2,3)16-13(11)9-12(10)15-4/h5-9H,1H2,2-4H3",C=Cc1cc2c(cc1OC)OC(C)(C)C=C2,C14H16O2,,216.115029752,RRUFTPKJXNXMAE,Terpenoids,Meroterpenoids,Merohemiterpenoids,Ageratum conyzoides,885278.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Ageratum'],['Ageratum conyzoides'],4,1,7.427672386169434 122,7382,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.7319181,ISDB,RRUFTPKJXNXMAE-UHFFFAOYSA-N,"InChI=1S/C14H16O2/c1-5-10-8-11-6-7-14(2,3)16-13(11)9-12(10)15-4/h5-9H,1H2,2-4H3",C=Cc1cc2c(cc1OC)OC(C)(C)C=C2,C14H16O2,,216.115029752,RRUFTPKJXNXMAE,Terpenoids,Meroterpenoids,Merohemiterpenoids,Encelia farinosa,380847.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Encelia'],['Encelia farinosa'],4,1,7.427672386169434 123,7381,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1proton1ammonium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 124,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 125,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-CFIIAAHPSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14?,15+,16?,17+,18?,19?,20?,21-,22+,23-/m1/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 126,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,0,6.0 127,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 128,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-BTBAWXFBSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum delphiniifolium,506023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum delphiniifolium'],6,0,6.0 129,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium roylei,6131791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium roylei'],6,0,6.0 130,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-GTRXRPRKSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14-,15+,16+,17-,18-,19-,20+,21-,22+,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,0,6.0 131,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ferox,1014250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ferox'],6,0,6.0 132,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 133,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pyramidale,782525.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pyramidale'],6,0,6.0 134,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-NZOCHXEQSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17+,18-,19-,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium,518366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Unknown'],6,0,6.0 135,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-UHFFFAOYSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 136,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-NZOCHXEQSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17+,18-,19-,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium denudatum,309508.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium denudatum'],6,0,6.0 137,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nagarum,488235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nagarum'],6,0,6.0 138,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 139,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum fukutomei,921880.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum bartlettii'],6,0,6.0 140,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 141,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nevadense,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 142,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum chasmanthum,5737840.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chasmanthum'],6,0,6.0 143,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-UHFFFAOYSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 144,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,0,6.0 145,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 146,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 147,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,0,6.0 148,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,0,6.0 149,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,0,6.0 150,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,0,6.0 151,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 152,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 153,7381,-1,,,,0.0,MS1_match,OUHXFIWCHDIJBE-GLJVVQBPSA-N,"InChI=1S/C23H37NO5/c1-5-24-10-21(2)15-7-13-20(24)23(15,17(26)8-16(21)25)12-6-11-14(28-3)9-22(13,29-4)18(12)19(11)27/h11-20,25-27H,5-10H2,1-4H3/t11-,12-,13+,14+,15-,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(C)[C@H](O)C[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,OUHXFIWCHDIJBE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 154,7381,-1,,,,0.0,MS1_match,GBBKFXYNDQUOGN-KOWPDBJSSA-N,"InChI=1S/C23H37NO5/c1-5-24-11-20(2)7-6-16(29-4)23-15(20)8-13(19(23)24)21(26)10-14(28-3)12-9-22(23,27)18(21)17(12)25/h12-19,25-27H,5-11H2,1-4H3/t12-,13+,14+,15-,16+,17+,18-,19-,20+,21+,22+,23+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,GBBKFXYNDQUOGN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,0,6.0 155,7381,-1,,,,0.0,MS1_match,MRAUUHCURXZDPX-KJJIZPFLSA-N,"InChI=1S/C23H37NO5/c1-5-24-11-20(2)7-6-16(25)23-13-8-12-14(28-3)9-22(29-4,17(13)18(12)26)21(27,19(23)24)10-15(20)23/h12-19,25-27H,5-11H2,1-4H3/t12-,13-,14+,15-,16+,17-,18+,19-,20+,21-,22-,23-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)(C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,MRAUUHCURXZDPX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 156,7381,-1,,,,0.0,MS1_match,MRAUUHCURXZDPX-KJJIZPFLSA-N,"InChI=1S/C23H37NO5/c1-5-24-11-20(2)7-6-16(25)23-13-8-12-14(28-3)9-22(29-4,17(13)18(12)26)21(27,19(23)24)10-15(20)23/h12-19,25-27H,5-11H2,1-4H3/t12-,13-,14+,15-,16+,17-,18+,19-,20+,21-,22-,23-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)(C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,MRAUUHCURXZDPX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium brunonianum,259375.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium minjanense'],6,0,6.0 157,7381,-1,,,,0.0,MS1_match,YNOQXHSVHMKQJS-UHFFFAOYSA-N,"InChI=1S/C23H37NO5/c1-5-24-10-21(2)7-6-14(25)23-12-8-11-13(28-3)9-22(29-4,15(12)17(11)26)16(20(23)24)18(27)19(21)23/h11-20,25-27H,5-10H2,1-4H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(C(O)C23)C14,C23H37NO5,pos_1_1proton,407.267173284,YNOQXHSVHMKQJS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,0,6.0 158,7381,-1,,,,0.0,MS1_match,YNOQXHSVHMKQJS-CEMIRNGBSA-N,"InChI=1S/C23H37NO5/c1-5-24-10-21(2)7-6-14(25)23-12-8-11-13(28-3)9-22(29-4,15(12)17(11)26)16(20(23)24)18(27)19(21)23/h11-20,25-27H,5-10H2,1-4H3/t11-,12-,13+,14+,15-,16-,17-,18-,19+,20+,21-,22-,23-/m0/s1",CCN1C[C@]2(C)CC[C@@H](O)[C@@]34[C@@H]2[C@@H](O)[C@@H]([C@@H]13)[C@]1(OC)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,YNOQXHSVHMKQJS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium favargeri,209870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium favargeri'],6,0,6.0 159,7381,-1,,,,0.0,MS1_match,HOCJNIVJUMYCKR-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(26)23-13-7-12-15(28-2)9-22(29-3,18(13)19(12)27)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,HOCJNIVJUMYCKR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida raveyi,733336.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida raveyi'],6,0,6.0 160,7381,-1,,,,0.0,MS1_match,HOCJNIVJUMYCKR-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(26)23-13-7-12-15(28-2)9-22(29-3,18(13)19(12)27)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,HOCJNIVJUMYCKR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium raveyi,733336.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida raveyi'],6,0,6.0 161,7381,-1,,,,0.0,MS1_match,HOCJNIVJUMYCKR-YPZZVLDDSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(26)23-13-7-12-15(28-2)9-22(29-3,18(13)19(12)27)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14-,15-,16+,17-,18?,19-,20+,21-,22-,23+/m0/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@@H](OC)C[C@@](OC)(C5[C@H]6O)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,HOCJNIVJUMYCKR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 162,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-HDCUTMFGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14-,15-,16+,17-,18-,19-,20+,21-,22-,23+/m0/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@@H]6[C@H](O)[C@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum contortum,909683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum contortum'],6,0,6.0 163,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-UHFFFAOYSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 164,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum liljestrandii,556434.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum liljestrandii'],6,0,6.0 165,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 166,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum dolichorhynchum,6131378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum dolichorhynchum'],6,0,6.0 167,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 168,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 169,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 170,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,0,6.0 171,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,0,6.0 172,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 173,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-HDCUTMFGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14-,15-,16+,17-,18-,19-,20+,21-,22-,23+/m0/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@@H]6[C@H](O)[C@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum contortum,909683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum contortum'],6,0,6.0 174,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-UHFFFAOYSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 175,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum liljestrandii,556434.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum liljestrandii'],6,0,6.0 176,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum dolichorhynchum,6131378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum dolichorhynchum'],6,0,6.0 177,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 178,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 179,7381,-1,,,,0.0,MS1_match,WCEASIFXIDFWHE-JPAZAREGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(29-3)23-13-7-12-15(28-2)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,WCEASIFXIDFWHE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 180,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 181,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 182,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 183,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 184,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 185,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 186,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sanyoense,675791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sanyoense'],6,0,6.0 187,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 188,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 189,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,0,6.0 190,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-YRNFJLKESA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nemorum,44343.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nemorum'],6,0,6.0 191,7381,-1,,,,0.0,MS1_match,MAFISJYAUUZDMK-GYXKTGJPSA-N,"InChI=1S/C23H37NO5/c1-5-24-10-21(2)7-6-14(25)23-12-8-11-13(28-3)9-22(27,15(12)17(11)26)16(20(23)24)18(29-4)19(21)23/h11-20,25-27H,5-10H2,1-4H3/t11-,12-,13+,14-,15-,16-,17-,18-,19+,20+,21-,22-,23-/m1/s1",CCN1C[C@@]2(C)CC[C@@H](O)[C@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@H]([C@@H](OC)[C@@H]23)[C@H]14,C23H37NO5,pos_1_1proton,407.267173284,MAFISJYAUUZDMK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 192,7381,-1,,,,0.0,MS1_match,QTYLIQYDCJFWRI-GJEMBUAKSA-N,"InChI=1S/C22H33NO4/c1-4-23(27)10-20(3)7-6-15(24)22-14(20)9-13(18(22)23)21-8-5-12(11(2)19(21)26)16(25)17(21)22/h12-19,24-26H,2,4-10H2,1,3H3/t12-,13+,14-,15+,16+,17-,18-,19-,20+,21+,22+,23?/m1/s1",C=C1[C@H]2CC[C@@]3([C@@H]1O)[C@@H]([C@H]2O)[C@@]12[C@@H]4C[C@H]3[C@H]1[N+]([O-])(CC)C[C@]4(C)CC[C@@H]2O,C22H33NO4,pos_1_1proton1methanol,375.240958536,QTYLIQYDCJFWRI,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kirinense,5737821.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kirinense'],6,0,6.0 193,7381,-1,,,,0.0,MS1_match,QQKAAJSZSAWUBV-UHFFFAOYSA-N,"InChI=1S/C22H33NO4/c1-4-23-9-20(3)6-5-14(24)22-13(20)7-12(18(22)23)21-8-11(10(2)19(21)27)15(25)16(26)17(21)22/h11-19,24-27H,2,4-9H2,1,3H3",C=C1C2CC3(C1O)C1CC4C5(C)CCC(O)C4(C1N(CC)C5)C3C(O)C2O,C22H33NO4,pos_1_1proton1methanol,375.240958536,QQKAAJSZSAWUBV,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum turczaninowii,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 194,7381,-1,,,,0.0,MS1_match,XWUKPLHDKUEVSQ-UHFFFAOYSA-N,"InChI=1S/C22H33NO4/c1-13-14-9-16-21(19(13)27,18(26)10-14)6-3-15-20(2)5-4-17(25)22(15,16)12-23(11-20)7-8-24/h14-17,19,24-25,27H,1,3-12H2,2H3",C=C1C2CC(=O)C3(CCC4C5(C)CCC(O)C4(CN(CCO)C5)C3C2)C1O,C22H33NO4,pos_1_1proton1methanol,375.240958536,XWUKPLHDKUEVSQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 195,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 196,7381,-1,,,,0.0,MS1_match,RYTZLEVRXNSDGJ-SRKQURDMSA-N,"InChI=1S/C22H33NO4/c1-4-23-18-12-8-14-20(2)6-5-15(27-19(20)23)22(14,18)11-7-10-13(26-3)9-21(12,25)16(11)17(10)24/h10-19,24-25H,4-9H2,1-3H3/t10-,11-,12+,13+,14-,15+,16-,17+,18-,19-,20-,21+,22-/m1/s1",CCN1[C@@H]2O[C@H]3CC[C@]2(C)[C@H]2C[C@H]4[C@@H]1[C@@]32[C@@H]1C[C@H]2[C@H](O)[C@@H]1[C@]4(O)C[C@@H]2OC,C22H33NO4,pos_1_1proton1methanol,375.240958536,RYTZLEVRXNSDGJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 197,7381,-1,,,,0.0,MS1_match,UUHRXVLKKDUSLH-NIUDVQOPSA-N,"InChI=1S/C22H33NO4/c1-4-23-9-20(3)14-5-12-18(23)22(14,17(26)7-16(20)25)15-6-13(24)11-8-21(12,15)19(27)10(11)2/h11-19,24-27H,2,4-9H2,1,3H3/t11-,12+,13-,14-,15-,16-,17+,18-,19-,20+,21+,22+/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1O)[C@@H](C[C@H]2O)[C@]12[C@@H]4C[C@H]3[C@H]1N(CC)C[C@]4(C)[C@H](O)C[C@@H]2O,C22H33NO4,pos_1_1proton1methanol,375.240958536,UUHRXVLKKDUSLH,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum brunneum,413968.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum brunneum'],6,0,6.0 198,7381,-1,,,,0.0,MS1_match,DEMQJEXKIJFBRD-UHFFFAOYSA-N,"InChI=1S/C22H33NO4/c1-4-23(27)10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3",C=C1C2CC3(C1O)C1CC4C5(C)CCC(O)C4(C3CC2O)C1[N+]([O-])(CC)C5,C22H33NO4,pos_1_1proton1methanol,375.240958536,DEMQJEXKIJFBRD,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 199,7381,-1,,,,0.0,MS1_match,DEMQJEXKIJFBRD-NWPVBJRSSA-N,"InChI=1S/C22H33NO4/c1-4-23(27)10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3/t12-,13+,14+,15-,16-,17+,18-,19-,20-,21+,22+,23-/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1O)[C@@H](C[C@@H]2O)[C@]12[C@@H]4C[C@H]3[C@H]1[N@@+]([O-])(CC)C[C@@]4(C)CC[C@@H]2O,C22H33NO4,pos_1_1proton1methanol,375.240958536,DEMQJEXKIJFBRD,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,0,6.0 200,7381,-1,,,,0.0,MS1_match,DEMQJEXKIJFBRD-NWPVBJRSSA-N,"InChI=1S/C22H33NO4/c1-4-23(27)10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3/t12-,13+,14+,15-,16-,17+,18-,19-,20-,21+,22+,23-/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1O)[C@@H](C[C@@H]2O)[C@]12[C@@H]4C[C@H]3[C@H]1[N@@+]([O-])(CC)C[C@@]4(C)CC[C@@H]2O,C22H33NO4,pos_1_1proton1methanol,375.240958536,DEMQJEXKIJFBRD,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum flavum,44348.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum flavum'],6,0,6.0 201,7381,-1,,,,0.0,MS1_match,DEMQJEXKIJFBRD-LGTBQFFLSA-N,"InChI=1S/C22H33NO4/c1-4-23(27)10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3/t12-,13?,14+,15?,16?,17+,18?,19-,20+,21-,22+,23?/m1/s1",C=C1[C@H]2C[C@]3(C4CC5[C@@]6(C)CC[C@H](O)[C@]5(C3C[C@@H]2O)C4[N+]([O-])(CC)C6)[C@@H]1O,C22H33NO4,pos_1_1proton1methanol,375.240958536,DEMQJEXKIJFBRD,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 202,7381,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-BZDFKLGJSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16-,17+,18+,19+,20-,21-,22-/m0/s1",C=C1[C@H]2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_1sodium1acetonitrile,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orochryseum,6131466.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orochryseum'],6,0,6.0 203,7381,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-JPMOWHAPSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16?,17-,18-,19-,20+,21+,22+/m1/s1",C=C1C2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_1sodium1acetonitrile,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,0,6.0 204,7381,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-BZDFKLGJSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16-,17+,18+,19+,20-,21-,22-/m0/s1",C=C1[C@H]2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_1sodium1acetonitrile,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,0,6.0 205,7381,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-BZDFKLGJSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16-,17+,18+,19+,20-,21-,22-/m0/s1",C=C1[C@H]2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_1sodium1acetonitrile,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium favargeri,209870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium favargeri'],6,0,6.0 206,7381,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1proton1ammonium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 207,7381,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1proton1ammonium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 208,7381,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1proton1ammonium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 209,7381,-1,,,,0.0,MS1_match,FYWKVUJEFHOLFV-IHABHUDHSA-N,"InChI=1S/C22H33NO4/c1-4-23-11-20(2)7-6-16(26-3)22-13-9-12-5-8-21(25,17(13)19(24)27-12)14(18(22)23)10-15(20)22/h12-18,25H,4-11H2,1-3H3/t12-,13-,14+,15-,16+,17-,18-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6CC[C@](O)([C@@H](C[C@H]23)[C@@H]14)[C@H]5C(=O)O6,C22H33NO4,pos_1_1proton1methanol,375.240958536,FYWKVUJEFHOLFV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum heterophyllum,124446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum heterophyllum'],6,0,6.0 210,7381,-1,,,,0.0,MS1_match,JQRBIDFJGMVSMU-YJBUWYFZSA-N,"InChI=1S/C23H37NO5/c1-5-24-11-20(2)7-6-16(25)23-15(20)8-13(19(23)24)21(26)10-14(28-3)12-9-22(23,27)18(21)17(12)29-4/h12-19,25-27H,5-11H2,1-4H3/t12-,13+,14-,15-,16-,17+,18-,19-,20+,21+,22+,23+/m1/s1",CCN1C[C@]2(C)CC[C@@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC,C23H37NO5,pos_1_1proton,407.267173284,JQRBIDFJGMVSMU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 211,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,0,6.0 212,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 213,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sanyoense,675791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sanyoense'],6,0,6.0 214,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 215,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 216,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,0,6.0 217,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-YRNFJLKESA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nemorum,44343.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nemorum'],6,0,6.0 218,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-CFIIAAHPSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14?,15+,16?,17+,18?,19?,20?,21-,22+,23-/m1/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 219,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,0,6.0 220,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 221,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-BTBAWXFBSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum delphiniifolium,506023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum delphiniifolium'],6,0,6.0 222,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium roylei,6131791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium roylei'],6,0,6.0 223,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-GTRXRPRKSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14-,15+,16+,17-,18-,19-,20+,21-,22+,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,0,6.0 224,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ferox,1014250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ferox'],6,0,6.0 225,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,0,6.0 226,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 227,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-NZOCHXEQSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17+,18-,19-,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium,518366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Unknown'],6,0,6.0 228,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-UHFFFAOYSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 229,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-NZOCHXEQSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17+,18-,19-,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium denudatum,309508.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium denudatum'],6,0,6.0 230,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nagarum,488235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nagarum'],6,0,6.0 231,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 232,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum fukutomei,921880.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum bartlettii'],6,0,6.0 233,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 234,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nevadense,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 235,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-PMLXDASCSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18+,19-,20?,21-,22-,23+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum chasmanthum,5737840.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chasmanthum'],6,0,6.0 236,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-UHFFFAOYSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 237,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-VHNKBEDGSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C23H37NO5,pos_1_1proton,407.2671732839999,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,0,6.0 238,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-KCHRERBJSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17-,18-,19+,20-,21+,22+,23-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]1[C@@H](C[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@@H]2O,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 239,7381,-1,,,,0.0,MS1_match,RBSZCNOWHDHRFZ-ZBEOZCTOSA-N,"InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13?,14+,15+,16?,17+,18?,19?,20?,21+,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)[C@@H](CC23)C14,C23H37NO5,pos_1_1proton,407.267173284,RBSZCNOWHDHRFZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pyramidale,782525.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pyramidale'],6,0,6.0 240,7381,-1,,,,0.0,MS1_match,SVTDHBCGROFNFY-CEMIRNGBSA-N,"InChI=1S/C23H37NO5/c1-5-24-10-21(2)7-6-14(29-4)23-12-8-11-13(28-3)9-22(27,15(12)17(11)25)16(20(23)24)18(26)19(21)23/h11-20,25-27H,5-10H2,1-4H3/t11-,12-,13+,14+,15-,16-,17-,18-,19+,20+,21-,22-,23-/m0/s1",CCN1C[C@]2(C)CC[C@@H](OC)[C@@]34[C@@H]2[C@@H](O)[C@@H]([C@@H]13)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C23H37NO5,pos_1_1proton,407.267173284,SVTDHBCGROFNFY,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium munzianum,6131738.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium munzianum'],6,0,6.0 241,7380,-1,,,,0.0,MS1_match,ZFMSMUAANRJZFM-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3",C=CCc1ccc(OC)cc1,C10H12O,pos_2MHNH3,148.088815004,ZFMSMUAANRJZFM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 242,7380,-1,,,,0.0,MS1_match,RUVINXPYWBROJD-ONEGZZNKSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+",C/C=C/c1ccc(OC)cc1,C10H12O,pos_2MHNH3,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 243,7380,-1,,,,0.0,MS1_match,ZYUGHWYPNFVSPX-UWGDBOAGSA-N,"InChI=1S/C20H27NO2/c1-9-10-3-12-16-20-6-11(22)5-18(2)8-21(16)13(15(18)20)7-19(12,17(9)23)14(20)4-10/h10-17,22-23H,1,3-8H2,2H3/t10-,11-,12+,13-,14+,15+,16+,17+,18-,19+,20+/m0/s1",C=C1[C@@H]2C[C@@H]3[C@]4(C[C@H]5[C@@H]6[C@@]7(C)C[C@H](O)C[C@@]36[C@@H]([C@H]4C2)N5C7)[C@@H]1O,C20H27NO2,pos_1_1proton,313.204179104,ZYUGHWYPNFVSPX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sanyoense,675791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sanyoense'],6,0,6.0 244,7380,-1,,,,0.0,MS1_match,PHDIRUNEPRFKTF-KATCSWHKSA-N,"InChI=1S/C20H27NO2/c1-9-10-5-11-16-20-13(6-10)19(11,17(9)23)7-12-15(20)18(2,8-21(12)16)4-3-14(20)22/h10-17,22-23H,1,3-8H2,2H3/t10-,11+,12-,13+,14+,15+,16+,17+,18+,19+,20-/m0/s1",C=C1[C@H]2C[C@@H]3[C@H]4N5C[C@@]6(C)CC[C@@H](O)[C@@]47[C@@H]6[C@@H]5C[C@]3([C@@H]1O)[C@H]7C2,C20H27NO2,pos_1_1proton,313.204179104,PHDIRUNEPRFKTF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,0,6.0 245,7380,-1,,,,0.0,MS1_match,PHDIRUNEPRFKTF-UHFFFAOYSA-N,"InChI=1S/C20H27NO2/c1-9-10-5-11-16-20-13(6-10)19(11,17(9)23)7-12-15(20)18(2,8-21(12)16)4-3-14(20)22/h10-17,22-23H,1,3-8H2,2H3",C=C1C2CC3C4N5CC6(C)CCC(O)C47C6C5CC3(C1O)C7C2,C20H27NO2,pos_1_1proton,313.204179104,PHDIRUNEPRFKTF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,0,6.0 246,7380,-1,,,,0.0,MS1_match,PHDIRUNEPRFKTF-UHFFFAOYSA-N,"InChI=1S/C20H27NO2/c1-9-10-5-11-16-20-13(6-10)19(11,17(9)23)7-12-15(20)18(2,8-21(12)16)4-3-14(20)22/h10-17,22-23H,1,3-8H2,2H3",C=C1C2CC3C4N5CC6(C)CCC(O)C47C6C5CC3(C1O)C7C2,C20H27NO2,pos_1_1proton,313.204179104,PHDIRUNEPRFKTF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium cossonianum,209868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cossonianum'],6,0,6.0 247,7380,-1,,,,0.0,MS1_match,WCHIUNLZAZRMKU-RXWAOHGHSA-N,"InChI=1S/C20H27NO2/c1-10-6-19-7-13-15-18(9-22)3-2-4-20(15)16(19)14(23)11(10)5-12(19)17(20)21(13)8-18/h11-17,22-23H,1-9H2/t11-,12-,13+,14+,15-,16-,17-,18+,19+,20+/m1/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@@]6(CO)CCC[C@@]57[C@@H]2[C@@H](O)[C@@H]1C[C@@H]3[C@H]7N4C6,C20H27NO2,pos_1_1proton,313.204179104,WCHIUNLZAZRMKU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium virgatum,885406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium virgatum'],6,0,6.0 248,7380,-1,,,,0.0,MS1_match,WCHIUNLZAZRMKU-RXWAOHGHSA-N,"InChI=1S/C20H27NO2/c1-10-6-19-7-13-15-18(9-22)3-2-4-20(15)16(19)14(23)11(10)5-12(19)17(20)21(13)8-18/h11-17,22-23H,1-9H2/t11-,12-,13+,14+,15-,16-,17-,18+,19+,20+/m1/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@@]6(CO)CCC[C@@]57[C@@H]2[C@@H](O)[C@@H]1C[C@@H]3[C@H]7N4C6,C20H27NO2,pos_1_1proton,313.204179104,WCHIUNLZAZRMKU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,0,6.0 249,7380,-1,,,,0.0,MS1_match,SYQIMSBCRURKCZ-UHFFFAOYSA-N,"InChI=1S/C20H27NO2/c1-9-10-6-11-16-19-5-3-4-18(2)8-21(16)12(14(18)19)7-20(11,17(9)23)15(19)13(10)22/h10-17,22-23H,1,3-8H2,2H3",C=C1C2CC3C4N5CC6(C)CCCC47C6C5CC3(C1O)C7C2O,C20H27NO2,pos_1_1proton,313.204179104,SYQIMSBCRURKCZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sachalinense,1064657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sachalinense'],6,0,6.0 250,7380,-1,,,,0.0,MS1_match,SYQIMSBCRURKCZ-ONZZGSHQSA-N,"InChI=1S/C20H27NO2/c1-9-10-6-11-16-19-5-3-4-18(2)8-21(16)12(14(18)19)7-20(11,17(9)23)15(19)13(10)22/h10-17,22-23H,1,3-8H2,2H3/t10-,11-,12+,13+,14-,15+,16-,17-,18-,19+,20-/m1/s1",C=C1[C@H]2C[C@@H]3[C@H]4N5C[C@@]6(C)CCC[C@]47[C@H]([C@H]2O)[C@]3(C[C@H]5[C@H]67)[C@@H]1O,C20H27NO2,pos_1_1proton,313.204179104,SYQIMSBCRURKCZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,0,6.0 251,7380,-1,,,,0.0,MS1_match,SYQIMSBCRURKCZ-ONZZGSHQSA-N,"InChI=1S/C20H27NO2/c1-9-10-6-11-16-19-5-3-4-18(2)8-21(16)12(14(18)19)7-20(11,17(9)23)15(19)13(10)22/h10-17,22-23H,1,3-8H2,2H3/t10-,11-,12+,13+,14-,15+,16-,17-,18-,19+,20-/m1/s1",C=C1[C@H]2C[C@@H]3[C@H]4N5C[C@@]6(C)CCC[C@]47[C@H]([C@H]2O)[C@]3(C[C@H]5[C@H]67)[C@@H]1O,C20H27NO2,pos_1_1proton,313.204179104,SYQIMSBCRURKCZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 252,7380,-1,,,,0.0,MS1_match,SYQIMSBCRURKCZ-ONZZGSHQSA-N,"InChI=1S/C20H27NO2/c1-9-10-6-11-16-19-5-3-4-18(2)8-21(16)12(14(18)19)7-20(11,17(9)23)15(19)13(10)22/h10-17,22-23H,1,3-8H2,2H3/t10-,11-,12+,13+,14-,15+,16-,17-,18-,19+,20-/m1/s1",C=C1[C@H]2C[C@@H]3[C@H]4N5C[C@@]6(C)CCC[C@]47[C@H]([C@H]2O)[C@]3(C[C@H]5[C@H]67)[C@@H]1O,C20H27NO2,pos_1_1proton,313.204179104,SYQIMSBCRURKCZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 253,7380,-1,,,,0.0,MS1_match,SYQIMSBCRURKCZ-UHFFFAOYSA-N,"InChI=1S/C20H27NO2/c1-9-10-6-11-16-19-5-3-4-18(2)8-21(16)12(14(18)19)7-20(11,17(9)23)15(19)13(10)22/h10-17,22-23H,1,3-8H2,2H3",C=C1C2CC3C4N5CC6(C)CCCC47C6C5CC3(C1O)C7C2O,C20H27NO2,pos_1_1proton,313.204179104,SYQIMSBCRURKCZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,0,6.0 254,7380,-1,,,,0.0,MS1_match,YKBXNPOUSBTDDB-PRLMBHFFSA-N,"InChI=1S/C20H27NO2/c1-10-7-18-8-20(23)16-17(2)4-3-5-19(16)14(18)13(22)11(10)6-12(18)15(19)21(20)9-17/h11-16,22-23H,1,3-9H2,2H3/t11-,12-,13-,14-,15-,16-,17+,18+,19+,20-/m1/s1",C=C1C[C@@]23C[C@@]4(O)[C@@H]5[C@@]6(C)CCC[C@@]57[C@@H]2[C@H](O)[C@@H]1C[C@@H]3[C@H]7N4C6,C20H27NO2,pos_1_1proton,313.204179104,YKBXNPOUSBTDDB,Terpenoids,Diterpenoids,Atisane diterpenoids,Delphinium venulosum,885408.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium venulosum'],6,0,6.0 255,7380,-1,,,,0.0,MS1_match,KTNFGMKTBBPQCI-BTAYRQPMSA-N,"InChI=1S/C20H27NO2/c1-11-12-8-13-15-19-5-3-4-17(2,10-21-15)20(19,23)7-6-18(13,16(11)22)14(19)9-12/h10,12-16,22-23H,1,3-9H2,2H3/t12-,13+,14+,15+,16-,17-,18+,19-,20-/m0/s1",C=C1[C@H]2C[C@@H]3[C@H]4N=C[C@]5(C)CCC[C@]46[C@H](C2)[C@]3(CC[C@@]65O)[C@H]1O,C20H27NO2,pos_1_1proton,313.204179104,KTNFGMKTBBPQCI,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum naviculare,5737802.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum naviculare'],6,0,6.0 256,7377,-1,,,,0.0,MS1_match,PULWZCUZNRVAHT-VBUZYTKISA-N,"InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16?,17-,18+,19-,20?,21+,22-,23-,24+,25-,26+,28+,29?,30+,31-/m1/s1",COC[C@]12CN(C)[C@@H]3C4[C@H](OC)[C@H]1[C@]3(C1CC3(O)[C@H](OC(=O)c5ccccc5)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]3OC)[C@@H](OC)C[C@H]2O,C31H43NO10,pos_1_1proton1methanol,589.288696576,PULWZCUZNRVAHT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 257,7377,-1,,,,0.0,MS1_match,PULWZCUZNRVAHT-VBUZYTKISA-N,"InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16?,17-,18+,19-,20?,21+,22-,23-,24+,25-,26+,28+,29?,30+,31-/m1/s1",COC[C@]12CN(C)[C@@H]3C4[C@H](OC)[C@H]1[C@]3(C1CC3(O)[C@H](OC(=O)c5ccccc5)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]3OC)[C@@H](OC)C[C@H]2O,C31H43NO10,pos_1_1proton1methanol,589.288696576,PULWZCUZNRVAHT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,0,6.0 258,7377,-1,,,,0.0,MS1_match,PULWZCUZNRVAHT-VBUZYTKISA-N,"InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16?,17-,18+,19-,20?,21+,22-,23-,24+,25-,26+,28+,29?,30+,31-/m1/s1",COC[C@]12CN(C)[C@@H]3C4[C@H](OC)[C@H]1[C@]3(C1CC3(O)[C@H](OC(=O)c5ccccc5)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]3OC)[C@@H](OC)C[C@H]2O,C31H43NO10,pos_1_1proton1methanol,589.288696576,PULWZCUZNRVAHT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 259,7377,-1,,,,0.0,MS1_match,YTEHIGWZSLFXJT-BHESEAIESA-N,"InChI=1S/C31H43NO10/c1-5-32-14-27(15-39-2)20(33)10-22(41-4)31-18-11-29(37)21(34)13-28(36,19(24(31)32)12-30(27,31)38)23(18)25(29)42-26(35)16-6-8-17(40-3)9-7-16/h6-9,18-25,33-34,36-38H,5,10-15H2,1-4H3/t18-,19-,20+,21-,22-,23-,24+,25+,27-,28+,29+,30-,31+/m0/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@H]5C[C@]6(O)[C@H](OC(=O)c7ccc(OC)cc7)[C@H]5[C@@](O)(C[C@@H]6O)[C@@H](C[C@]23O)[C@@H]14,C31H43NO10,pos_1_1proton1methanol,589.288696576,YTEHIGWZSLFXJT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,0,6.0 260,7375,916,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.2759786,ISDB,DKVQOAMBVKKPAM-MDZDMXLPSA-N,"InChI=1S/C13H16O/c1-4-13(2,3)10-9-11-5-7-12(14)8-6-11/h4-10,14H,1H2,2-3H3/b10-9+",C=CC(C)(C)/C=C/c1ccc(O)cc1,C13H16O,,188.120115132,DKVQOAMBVKKPAM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cullen corylifolia,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.603914380073547 261,7375,916,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.2759786,ISDB,DKVQOAMBVKKPAM-MDZDMXLPSA-N,"InChI=1S/C13H16O/c1-4-13(2,3)10-9-11-5-7-12(14)8-6-11/h4-10,14H,1H2,2-3H3/b10-9+",C=CC(C)(C)/C=C/c1ccc(O)cc1,C13H16O,,188.120115132,DKVQOAMBVKKPAM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cullen corylifolium,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.603914380073547 262,7372,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KZNWWOXBZGCGSK-UHFFFAOYSA-N,"InChI=1S/C11H10O3/c1-13-5-9-6-14-7-11-8(4-12)2-3-10(9)11/h2-4,6-7H,5H2,1H3",COCc1cocc2c(C=O)ccc1-2,C11H10O3,pos_1_1proton1ammonium,190.06299418,KZNWWOXBZGCGSK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 263,7371,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,CDOSHBSSFJOMGT-UHFFFAOYSA-N,"InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3",C=CC(C)(O)CCC=C(C)C,C10H18O,pos_1_1proton1acetonitrile,154.135765196,CDOSHBSSFJOMGT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 264,7371,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,CDOSHBSSFJOMGT-UHFFFAOYSA-N,"InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3",C=CC(C)(O)CCC=C(C)C,C10H18O,pos_1_1proton1acetonitrile,154.135765196,CDOSHBSSFJOMGT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 265,7370,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,ZTDLEPCPWDWZOM-IOQDTQQCSA-N,"InChI=1S/C30H26O12/c31-16-6-1-14(2-7-16)3-10-23(35)40-13-22-26(36)28(38)29(39)30(42-22)25-19(34)12-21-24(27(25)37)18(33)11-20(41-21)15-4-8-17(32)9-5-15/h1-12,22,26,28-32,34,36-39H,13H2/b10-3+/t22-,26-,28+,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](c2c(O)cc3oc(-c4ccc(O)cc4)cc(=O)c3c2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O12,pos_1_1proton,578.142426272,ZTDLEPCPWDWZOM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,2,9.0 266,7370,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,UTUISHMYVAZILQ-UHFFFAOYSA-N,"InChI=1S/C30H26O12/c31-14-24-29(42-25(36)10-3-15-1-6-17(32)7-2-15)27(37)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2",O=C(C=Cc1ccc(O)cc1)OC1C(CO)OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)C(O)C1O,C30H26O12,pos_1_1proton,578.142426272,UTUISHMYVAZILQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,2,9.0 267,7369,-1,,,,0.0,MS1_match,AAKYADOUWNFWOI-SNXGJFJPSA-N,"InChI=1S/C20H26O3/c1-11(21)14-5-6-16-15-4-3-12-9-13(22)7-8-20(12,2)17(15)10-18(23)19(14)16/h3,13-15,17,22H,4-10H2,1-2H3/t13-,14+,15-,17+,20-/m0/s1",CC(=O)[C@H]1CCC2=C1C(=O)C[C@@H]1[C@H]2CC=C2C[C@@H](O)CC[C@@]21C,C20H26O3,pos_1_1proton1ammonium,314.188194692,AAKYADOUWNFWOI,Terpenoids,Steroids,Pregnane steroids,Adonis amurensis,243850.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis amurensis'],6,0,6.0 268,7369,-1,,,,0.0,MS1_match,XNFQUGPVHYJHHZ-PMCSWTMGSA-N,"InChI=1S/C20H29NO3/c1-9-5-19-4-3-11-18(2)6-10(22)7-20(11)16(19)15(24)12(9)14(23)13(19)17(20)21-8-18/h10-17,21-24H,1,3-8H2,2H3/t10-,11+,12-,13+,14+,15+,16+,17+,18-,19+,20-/m0/s1",C=C1C[C@]23CC[C@@H]4[C@]5(C)CN[C@@H]6[C@H]2[C@H](O)[C@H]1[C@@H](O)[C@H]3[C@@]64C[C@@H](O)C5,C20H29NO3,pos_1_1proton,331.214743788,XNFQUGPVHYJHHZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,0,6.0 269,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 270,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 271,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 272,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_sodium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 273,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_sodium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 274,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_sodium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 275,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 276,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 277,7368,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NEVMWOQJRSZYIC-UUANRDTJSA-N,"InChI=1S/C30H36O18/c1-39-13-5-11-6-14(40-2)25(13)47-29-23(35)21(33)19(31)17(45-29)10-44-28(38)12-7-15(41-3)26(16(8-12)42-4)48-30-24(36)22(34)20(32)18(46-30)9-43-27(11)37/h5-8,17-24,29-36H,9-10H2,1-4H3/t17-,18-,19-,20-,21+,22+,23-,24-,29+,30+/m1/s1",COc1cc2cc(OC)c1O[C@@H]1O[C@H](COC(=O)c3cc(OC)c(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C30H36O18,pos_2_2sodium,684.190164312,NEVMWOQJRSZYIC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 278,7367,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 279,7367,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 280,7367,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 281,7367,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1ammonium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 282,7367,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1ammonium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 283,7367,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1ammonium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 284,7367,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 285,7367,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 286,7362,1629,Terpenoids,Sesquiterpenoids,Other Octadecanoids,0.2407922,ISDB,RRFWQKAQYSNZEU-PYADLVFVSA-N,"InChI=1S/C17H24O5/c1-9-4-5-12-10(2)16(20)22-15(12)17(8-21-11(3)18)13(9)6-7-14(17)19/h9-10,12-13,15H,4-8H2,1-3H3/t9-,10-,12-,13-,15+,17-/m0/s1",CC(=O)OC[C@@]12C(=O)CC[C@H]1[C@@H](C)CC[C@H]1[C@H](C)C(=O)O[C@H]12,C17H24O5,,308.162373868,RRFWQKAQYSNZEU,Terpenoids,Sesquiterpenoids,Pseudoguaiane sesquiterpenoids,Rudbeckia mollis,36535.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Rudbeckia'],['Rudbeckia mollis'],4,2,5.963168799877167 287,7360,-1,,,,0.0,MS1_match,IJVBJQZGTABEMP-CONSDPRKSA-N,"InChI=1S/C42H52N2O10/c1-43-15-13-25-20-34(47-4)35(22-28(25)30(43)17-24-11-12-33(46-3)32(45)18-24)54-37-21-26(38(49-6)42(53-10)41(37)52-9)19-31-29-23-36(48-5)40(51-8)39(50-7)27(29)14-16-44(31)2/h11-12,18,20-23,30-31,45H,13-17,19H2,1-10H3/t30-,31-/m0/s1",COc1ccc(C[C@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)c(OC)c6CCN5C)c(OC)c(OC)c4OC)c(OC)cc3CCN2C)cc1O,C42H52N2O10,pos_1_minus1proton2sodium,744.362195864,IJVBJQZGTABEMP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Isopyrum thalictroides,949657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Isopyrum'],['Isopyrum thalictroides'],6,0,6.0 288,7357,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.43647423,ISDB,JZVYLXIIJTXKCL-CSQYNZLRSA-N,"InChI=1S/C22H38O4/c1-17(2)12-13-22(25)19(4)9-7-11-21(16-26-20(5)24)10-6-8-18(3)14-15-23/h10,12,14,19,22-23,25H,6-9,11,13,15-16H2,1-5H3/b18-14+,21-10-/t19-,22+/m0/s1",CC(=O)OC/C(=C\CC/C(C)=C/CO)CCC[C@H](C)[C@H](O)CC=C(C)C,C22H38O4,,366.277009696,JZVYLXIIJTXKCL,Terpenoids,Diterpenoids,Phytane diterpenoids,Carpesium triste,792531.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Carpesium'],['Carpesium triste'],4,2,6.745896935462952 289,7355,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.286411,ISDB,NEIGCWDMEKOLNJ-FAHMQYDOSA-N,"InChI=1S/C38H48O5/c1-22(2)14-13-15-24(5)18-19-36-20-27-28-30(40)34(6,7)26(23(3)4)21-37(28,31(36)41)33(43)38(32(36)42,35(27,8)9)29(39)25-16-11-10-12-17-25/h10-12,14,16-18,26-28,30,40H,3,13,15,19-21H2,1-2,4-9H3/b24-18+/t26-,27-,28-,30-,36+,37-,38+/m0/s1",C=C(C)[C@@H]1C[C@@]23C(=O)[C@@]4(C/C=C(\C)CCC=C(C)C)C[C@@H]([C@H]2[C@H](O)C1(C)C)C(C)(C)[C@](C(=O)c1ccccc1)(C4=O)C3=O,C38H48O5,,584.350174636,NEIGCWDMEKOLNJ,Polyketides,Meroterpenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),Hypericum sampsonii,354150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum sampsonii'],4,0,5.145643949508667 290,7350,-1,,,,0.0,MS1_match,PMHQEEVEMWGOAI-HVTOOLEBSA-N,"InChI=1S/C37H60O10/c1-18-15-19-28(32(4,5)43-8)47-37(46-19)27(18)33(6)13-14-36-17-35(36)12-11-23(45-29-26(41)25(40)24(39)20(16-38)44-29)31(2,3)21(35)9-10-22(36)34(33,7)30(37)42/h18-30,38-42H,9-17H2,1-8H3/t18-,19-,20-,21+,22+,23+,24+,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37+/m1/s1",COC(C)(C)[C@H]1O[C@@]23O[C@@H]1C[C@@H](C)[C@@H]2[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@H]3O,C37H60O10,pos_2MHNH3,664.41864812,PMHQEEVEMWGOAI,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 291,7350,-1,,,,0.0,MS1_match,PMHQEEVEMWGOAI-HVTOOLEBSA-N,"InChI=1S/C37H60O10/c1-18-15-19-28(32(4,5)43-8)47-37(46-19)27(18)33(6)13-14-36-17-35(36)12-11-23(45-29-26(41)25(40)24(39)20(16-38)44-29)31(2,3)21(35)9-10-22(36)34(33,7)30(37)42/h18-30,38-42H,9-17H2,1-8H3/t18-,19-,20-,21+,22+,23+,24+,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37+/m1/s1",COC(C)(C)[C@H]1O[C@@]23O[C@@H]1C[C@@H](C)[C@@H]2[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@H]3O,C37H60O10,pos_2MHNH3,664.41864812,PMHQEEVEMWGOAI,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 292,7350,-1,,,,0.0,MS1_match,WLWKLTIIRAWGET-BIBQQZBKSA-N,"InChI=1S/C37H60O10/c1-19(38)45-29-27(42)28(34(7)13-11-24(47-34)32(4,5)43)33(6)15-16-37-18-36(37)14-12-23(46-30-26(41)25(40)20(39)17-44-30)31(2,3)21(36)9-10-22(37)35(29,33)8/h20-30,39-43H,9-18H2,1-8H3/t20-,21+,22+,23+,24-,25+,26-,27-,28+,29+,30+,33-,34-,35-,36-,37+/m1/s1",CC(=O)O[C@H]1[C@H](O)[C@H]([C@@]2(C)CC[C@H](C(C)(C)O)O2)[C@@]2(C)CC[C@@]34C[C@@]35CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@@H]5CC[C@H]4[C@]12C,C37H60O10,pos_2MHNH3,664.41864812,WLWKLTIIRAWGET,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 293,7350,-1,,,,0.0,MS1_match,BOECQQUDFVMJFS-BSRPRUHBSA-N,"InChI=1S/C37H60O10/c1-19(2)15-21-27(40)26(31(44-6)45-21)20-9-11-35(5)24-8-7-23-33(3,18-39)25(47-32-30(43)29(42)28(41)22(16-38)46-32)10-12-36(23)17-37(24,36)14-13-34(20,35)4/h15,20-32,38-43H,7-14,16-18H2,1-6H3/t20-,21-,22-,23+,24-,25+,26+,27-,28-,29+,30-,31-,32+,33-,34-,35+,36-,37+/m1/s1",CO[C@@H]1O[C@H](C=C(C)C)[C@@H](O)[C@@H]1[C@H]1CC[C@@]2(C)[C@H]3CC[C@H]4[C@@](C)(CO)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C,C37H60O10,pos_2MHNH3,664.41864812,BOECQQUDFVMJFS,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum squarrosum,451574.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum squarrosum'],6,0,6.0 294,7350,-1,,,,0.0,MS1_match,SINCDAOITNCHRQ-CEHVUTQISA-N,"InChI=1S/C36H60O10/c1-30(2)21-7-8-22-32(5)15-19(39)28(33(6)11-9-24(46-33)31(3,4)43)36(32,18-38)14-13-35(22)17-34(21,35)12-10-23(30)45-29-27(42)26(41)25(40)20(16-37)44-29/h19-29,37-43H,7-18H2,1-6H3/t19-,20+,21-,22-,23-,24+,25+,26-,27+,28+,29-,32-,33-,34+,35-,36-/m0/s1",CC(C)(O)[C@H]1CC[C@@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]23CO)O1,C36H60O10,pos_2MHCH3CN,652.41864812,SINCDAOITNCHRQ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 295,7347,-1,,,,0.0,MS1_match,TUNFSRHWOTWDNC-UHFFFAOYSA-N,"InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)",CCCCCCCCCCCCCC(=O)O,C14H28O2,pos_1_1proton1acetonitrile,228.208930136,TUNFSRHWOTWDNC,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 296,7347,-1,,,,0.0,MS1_match,TUNFSRHWOTWDNC-UHFFFAOYSA-N,"InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)",CCCCCCCCCCCCCC(=O)O,C14H28O2,pos_1_1proton1acetonitrile,228.208930136,TUNFSRHWOTWDNC,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 297,7347,-1,,,,0.0,MS1_match,TUNFSRHWOTWDNC-UHFFFAOYSA-N,"InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)",CCCCCCCCCCCCCC(=O)O,C14H28O2,pos_1_1proton1acetonitrile,228.208930136,TUNFSRHWOTWDNC,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 298,7347,-1,,,,0.0,MS1_match,TUNFSRHWOTWDNC-UHFFFAOYSA-N,"InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)",CCCCCCCCCCCCCC(=O)O,C14H28O2,pos_1_1proton1acetonitrile,228.208930136,TUNFSRHWOTWDNC,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 299,7347,-1,,,,0.0,MS1_match,TUNFSRHWOTWDNC-UHFFFAOYSA-N,"InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)",CCCCCCCCCCCCCC(=O)O,C14H28O2,pos_1_1proton1acetonitrile,228.208930136,TUNFSRHWOTWDNC,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Thalictrum revolutum,421843.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum revolutum'],6,0,6.0 300,7347,-1,,,,0.0,MS1_match,HQRWEDFDJHDPJC-UHFFFAOYSA-N,"InChI=1S/C33H66O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33(34)35/h2-32H2,1H3,(H,34,35)",CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O,C33H66O2,pos_2_2sodium,494.506281352,HQRWEDFDJHDPJC,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 301,7345,818,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,0.5089156,ISDB,HMZRYPLRIDLTNP-UHFFFAOYSA-N,"InChI=1S/C13H15NO5/c15-8-5-9-10(11(16)6-8)7-14(13(9)19)4-2-1-3-12(17)18/h5-6,15-16H,1-4,7H2,(H,17,18)",O=C(O)CCCCN1Cc2c(O)cc(O)cc2C1=O,C13H15NO5,,265.09502258,HMZRYPLRIDLTNP,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,Meyerozyma guilliermondii,334025.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Unknown'],['Saccharomycetales'],['Debaryomycetaceae'],['Unknown'],['Meyerozyma'],['Meyerozyma guilliermondii'],1,3,4.535662412643433 302,7343,-1,,,,0.69286925,ISDB,GDLQIXUEVDYLAX-CWYSQHEVSA-N,"InChI=1S/C20H26O6/c1-10(2)12-8-20(24)17-11(16(12)23)5-6-13-18(3,9-21)14(22)7-15(25-26-20)19(13,17)4/h8,10,13,15,21,24H,5-7,9H2,1-4H3/t13-,15+,18+,19+,20+/m0/s1",CC(C)C1=C[C@@]2(O)OO[C@@H]3CC(=O)[C@](C)(CO)[C@@H]4CCC(=C2[C@]43C)C1=O,C20H26O6,,362.172938552,GDLQIXUEVDYLAX,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],4,0,6.771476984024048 303,7338,864,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,0.69542825,ISDB,FFIHXENRVXVAGQ-UVLSWTAMSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11+,13-,14-/m1/s1",CC/C=C1/C=CC(=O)[C@@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Curvularia pallescens,868065.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Cochliobolus'],['Pseudocochliobolus pallescens'],1,3,5.281713008880615 304,7338,864,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,0.69542825,ISDB,FFIHXENRVXVAGQ-UVLSWTAMSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11+,13-,14-/m1/s1",CC/C=C1/C=CC(=O)[C@@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Staphylotrichum coccosporum,630050.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Sordariales'],['Chaetomiaceae'],['Unknown'],['Staphylotrichum'],['Staphylotrichum coccosporum'],1,3,5.281713008880615 305,7338,864,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,0.69542825,ISDB,FFIHXENRVXVAGQ-KZZKGCKGSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1",CC/C=C1/C=CC(=O)[C@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Drechslera,432344.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Drechslera'],['Unknown'],1,3,5.281713008880615 306,7338,864,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,0.69542825,ISDB,FFIHXENRVXVAGQ-KZZKGCKGSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1",CC/C=C1/C=CC(=O)[C@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Pyrenophora tritici-repentis,85506.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Pyrenophora'],['Pyrenophora tritici-repentis'],1,3,5.281713008880615 307,7337,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 308,7337,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 309,7337,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 310,7337,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 311,7337,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 312,7337,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,3,7.5 313,7334,-1,,,,0.2926243,ISDB,,,,,,,NVQPWUVLWFUODC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.170497179031372 314,7333,-1,,,,0.0,MS1_match,OFMXGFHWLZPCFL-SVRPQWSVSA-N,"InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3CC(C)(C)CC[C@]3(C)CC[C@]12C,C30H50O,pos_1_1proton1acetonitrile,426.38616622,OFMXGFHWLZPCFL,Terpenoids,Triterpenoids,Friedelane triterpenoids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 315,7333,-1,,,,0.0,MS1_match,JFSHUTJDVKUMTJ-QHPUVITPSA-N,"InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21-,22-,23+,24-,27+,28-,29+,30+/m0/s1",CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H50O,pos_1_1proton1acetonitrile,426.3861662199999,JFSHUTJDVKUMTJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 316,7333,-1,,,,0.0,MS1_match,JFSHUTJDVKUMTJ-QHPUVITPSA-N,"InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21-,22-,23+,24-,27+,28-,29+,30+/m0/s1",CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H50O,pos_1_1proton1acetonitrile,426.3861662199999,JFSHUTJDVKUMTJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 317,7330,559,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.85616654,ISDB,MGUTYWPZCZBAGE-JZDIRDTQSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h14,16,19-20,22-23,25,27,31,33,42H,6-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H78NO8P,,779.546505086,MGUTYWPZCZBAGE,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,5.924666166305542 318,7330,559,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.85616654,ISDB,MGUTYWPZCZBAGE-JZDIRDTQSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h14,16,19-20,22-23,25,27,31,33,42H,6-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H78NO8P,,779.546505086,MGUTYWPZCZBAGE,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,5.924666166305542 319,7329,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,IZODPOCIKVLNIL-ZMBMZZJNSA-N,"InChI=1S/C18H28O11/c1-7-12-8(4-11(24-2)27-7)9(16(23)25-3)6-26-17(12)29-18-15(22)14(21)13(20)10(5-19)28-18/h6-8,10-15,17-22H,4-5H2,1-3H3/t7-,8+,10+,11+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](OC)C[C@H]12,C18H28O11,pos_1_minus1proton2sodium,420.1631617159999,IZODPOCIKVLNIL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 320,7329,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,IZODPOCIKVLNIL-ZMBMZZJNSA-N,"InChI=1S/C18H28O11/c1-7-12-8(4-11(24-2)27-7)9(16(23)25-3)6-26-17(12)29-18-15(22)14(21)13(20)10(5-19)28-18/h6-8,10-15,17-22H,4-5H2,1-3H3/t7-,8+,10+,11+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](OC)C[C@H]12,C18H28O11,pos_1_minus1proton2sodium,420.1631617159999,IZODPOCIKVLNIL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 321,7329,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,IZODPOCIKVLNIL-ZMBMZZJNSA-N,"InChI=1S/C18H28O11/c1-7-12-8(4-11(24-2)27-7)9(16(23)25-3)6-26-17(12)29-18-15(22)14(21)13(20)10(5-19)28-18/h6-8,10-15,17-22H,4-5H2,1-3H3/t7-,8+,10+,11+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](OC)C[C@H]12,C18H28O11,pos_1_minus1proton2sodium,420.1631617159999,IZODPOCIKVLNIL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 322,7326,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_2MNa,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 323,7324,-1,,,,0.7014132,ISDB,SDJMNNDDHQWWJH-UXCAXZQLSA-N,"InChI=1S/C18H26O3/c1-16-6-5-14(20)8-12(16)4-7-17-9-13(2-3-15(16)17)18(21,10-17)11-19/h5-6,12-13,15,19,21H,2-4,7-11H2,1H3/t12-,13-,15+,16-,17+,18+/m1/s1",C[C@@]12C=CC(=O)C[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(CO)C3,C18H26O3,,290.188194692,SDJMNNDDHQWWJH,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Diplospora dubia,729058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora dubia'],4,0,6.805652856826782 324,7312,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.20232263,ISDB,RSVFJNWBMXVMGE-LXQXRHSASA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-23-36-33(5)25-34(41)26-38(36,6)7)15-11-12-16-30(2)18-14-20-32(4)22-24-37(43)40(10)28-35(42)27-39(40,8)9/h11-24,34,41H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t34-,40+/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C(=O)[C@]2(C)CC(=O)CC2(C)C)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,RSVFJNWBMXVMGE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-κ)",Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,5.809290528297424 325,7310,312,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.6239671,ISDB,QGYGWYUQPCKNKZ-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-17-7-4-13(11-16(17)22)5-8-19(23)20-10-9-14-3-6-15(21)18(12-14)25-2/h3-8,11-12,21-22H,9-10H2,1-2H3,(H,20,23)/b8-5+",COc1ccc(/C=C/C(=O)NCCc2ccc(O)c(OC)c2)cc1O,C19H21NO5,,343.141972772,QGYGWYUQPCKNKZ,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Chenopodium album,892395.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Atripliceae'],['Chenopodium'],['Chenopodium album'],0,3,3.995868444442749 326,7307,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.58375895,ISDB,WJICHKNOWJBIKJ-LVQVYYBASA-N,"InChI=1S/C20H27NO7/c1-11(22)27-16-9-13-8-14(10-15(16)21(13)2)28-20(23)12-6-17(24-3)19(26-5)18(7-12)25-4/h6-7,13-16H,8-10H2,1-5H3/t13-,14-,15+,16-/m1/s1",COc1cc(C(=O)O[C@@H]2C[C@@H]3C[C@@H](OC(C)=O)[C@H](C2)N3C)cc(OC)c1OC,C20H27NO7,,393.178752204,WJICHKNOWJBIKJ,Alkaloids,Ornithine alkaloids,Tropane alkaloids,Erythroxylum zeylanicum,6100416.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Erythroxylaceae'],['Unknown'],['Erythroxylum'],['Erythroxylum zeylanicum'],0,1,2.835035800933838 327,7305,-1,,,,0.5073528,ISDB,,,,,,,KDFFHQWIQPWMSY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.0294113159179688 328,7304,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.71896344,ISDB,SDLILULALIDNSO-UHFFFAOYSA-N,"InChI=1S/C16H19NO3/c1-20-16-7-4-13(10-15(16)19)11-17-9-8-12-2-5-14(18)6-3-12/h2-7,10,17-19H,8-9,11H2,1H3",COc1ccc(CNCCc2ccc(O)cc2)cc1O,C16H19NO3,,273.136493468,SDLILULALIDNSO,Alkaloids,Tyrosine alkaloids,Phenylethylamines,Crinum kirkii,118198.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Crinum'],['Crinum kirkii'],0,2,3.8758537769317627 329,7288,-1,,,,0.830742,ISDB,JLZABDZBCSSSEW-SDRDYGDLSA-N,"InChI=1S/C32H38O19/c1-11-19(37)23(41)27(51-31-28(43)32(44,9-33)10-46-31)30(47-11)45-8-17-20(38)22(40)24(42)29(49-17)50-26-21(39)18-15(36)6-14(35)7-16(18)48-25(26)12-2-4-13(34)5-3-12/h2-7,11,17,19-20,22-24,27-31,33-38,40-44H,8-10H2,1H3/t11-,17+,19-,20-,22-,23+,24+,27+,28-,29-,30+,31-,32+/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@H](O)[C@H]1O,C32H38O19,,726.200728996,JLZABDZBCSSSEW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Chenopodium quinoa,117198.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Atripliceae'],['Chenopodium'],['Chenopodium quinoa'],4,0,7.322968006134033 330,7286,741,Terpenoids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 331,7286,741,Terpenoids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,1,7.5 332,7286,741,Terpenoids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,1,7.5 333,7286,741,Terpenoids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,1,7.5 334,7286,741,Terpenoids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,1,7.5 335,7286,741,Terpenoids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 336,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-UHFFFAOYSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2",O=C1CC(c2ccc(OC3OC(CO)C(O)C(O)C3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.126382284,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Glycyrrhiza inflata,284049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza inflata'],4,0,6.485324144363403 337,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-ZRWXNEIDSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17+,18+,19-,20+,21+/m0/s1",O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.12638228399993,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Tetradium glabrifolium,164592.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Tetradium'],['Tetradium glabrifolium'],4,0,6.485324144363403 338,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-ZRWXNEIDSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17+,18+,19-,20+,21+/m0/s1",O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.12638228399993,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Artemisia capillaris,361562.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia capillaris'],4,0,6.485324144363403 339,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-ZRWXNEIDSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17+,18+,19-,20+,21+/m0/s1",O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.12638228399993,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Portulaca oleracea,883494.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Portulacaceae'],['Unknown'],['Portulaca'],['Portulaca oleracea'],4,0,6.485324144363403 340,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-ZRWXNEIDSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17+,18+,19-,20+,21+/m0/s1",O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.12638228399993,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Glycyrrhiza glabra,554264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza glabra'],4,0,6.485324144363403 341,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-ONJCETCRSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17-,18-,19+,20-,21-/m1/s1",O=C1C[C@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.1263822839999,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Lagochilus leiacanthus,7054108.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Leonureae'],['Lagochilus'],['Lagochilus leiacanthus'],4,0,6.485324144363403 342,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-ZRWXNEIDSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17+,18+,19-,20+,21+/m0/s1",O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.12638228399993,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Glycyrrhiza uralensis,284051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza uralensis'],4,0,6.485324144363403 343,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-UHFFFAOYSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2",O=C1CC(c2ccc(OC3OC(CO)C(O)C(O)C3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.126382284,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Glycyrrhiza aspera,786652.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza aspera'],4,0,6.485324144363403 344,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-UZQFATADSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15?,17-,18-,19+,20-,21-/m1/s1",O=C1CC(c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.1263822839999,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Glycyrrhiza,841875.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Unknown'],4,0,6.485324144363403 345,7283,-1,,,,0.62133104,ISDB,DEMKZLAVQYISIA-ZRWXNEIDSA-N,"InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17+,18+,19-,20+,21+/m0/s1",O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C21H22O9,,418.12638228399993,DEMKZLAVQYISIA,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Polygonum aviculare,143996.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Polygonaceae'],['Polygoneae'],['Polygonum'],['Polygonum aviculare'],4,0,6.485324144363403 346,7282,-1,,,,0.26914927,ISDB,,,,,,,APWUUZRAVVATRC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0765970945358276 347,7280,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.35433343,ISDB,SNQGUUAIGCZPGG-VIFPVBQESA-N,"InChI=1S/C13H14O2/c1-8(2)9-5-10-6-11(14)3-4-12(10)13(15)7-9/h3-4,6,9,14H,1,5,7H2,2H3/t9-/m0/s1",C=C(C)[C@@H]1CC(=O)c2ccc(O)cc2C1,C13H14O2,,202.099379688,SNQGUUAIGCZPGG,Terpenoids,Sesquiterpenoids,Noreudesmane sesquiterpenoids,Ligularia japonica,483666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia japonica'],4,2,6.417333722114563 348,7280,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.35433343,ISDB,SNQGUUAIGCZPGG-UHFFFAOYSA-N,"InChI=1S/C13H14O2/c1-8(2)9-5-10-6-11(14)3-4-12(10)13(15)7-9/h3-4,6,9,14H,1,5,7H2,2H3",C=C(C)C1CC(=O)c2ccc(O)cc2C1,C13H14O2,,202.099379688,SNQGUUAIGCZPGG,Terpenoids,Sesquiterpenoids,Noreudesmane sesquiterpenoids,Ligularia dentata,1010107.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia dentata'],4,2,6.417333722114563 349,7280,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.35433343,ISDB,SNQGUUAIGCZPGG-UHFFFAOYSA-N,"InChI=1S/C13H14O2/c1-8(2)9-5-10-6-11(14)3-4-12(10)13(15)7-9/h3-4,6,9,14H,1,5,7H2,2H3",C=C(C)C1CC(=O)c2ccc(O)cc2C1,C13H14O2,,202.099379688,SNQGUUAIGCZPGG,Terpenoids,Sesquiterpenoids,Noreudesmane sesquiterpenoids,Ligularia odontomanes,7610300.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia odontomanes'],4,2,6.417333722114563 350,7279,1134,Fatty acids,Diterpenoids,Glycerophosphocholines,0.79111505,ISDB,WTJKGGKOPKCXLL-VYOBOKEXSA-N,"InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C42H82NO8P,,759.577805214,WTJKGGKOPKCXLL,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,8.664460182189941 351,7279,1134,Fatty acids,Diterpenoids,Glycerophosphocholines,0.79111505,ISDB,WTJKGGKOPKCXLL-PFDVCBLKSA-N,"InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m0/s1",CCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C42H82NO8P,,759.577805214,WTJKGGKOPKCXLL,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Dioscorea oppositifolia,981893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dioscoreales'],['Dioscoreaceae'],['Unknown'],['Dioscorea'],['Dioscorea oppositifolia'],4,3,8.664460182189941 352,7275,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,YVPYMQHYESYLIR-HZKWNRCISA-N,"InChI=1S/C36H51NO12/c1-9-37-16-33(17-42-3)23(39)13-24(45-6)36-20-14-34(41)25(46-7)15-35(49-18(2)38,27(30(36)37)28(47-8)29(33)36)26(20)31(34)48-32(40)19-10-11-21(43-4)22(12-19)44-5/h10-12,20,23-31,39,41H,9,13-17H2,1-8H3/t20-,23-,24+,25+,26-,27+,28+,29-,30-,31-,33+,34+,35-,36+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](OC(C)=O)([C@H]5[C@H]6OC(=O)c5ccc(OC)c(OC)c5)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C36H51NO12,pos_1_1proton,689.341126072,YVPYMQHYESYLIR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 353,7275,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,YVPYMQHYESYLIR-HZKWNRCISA-N,"InChI=1S/C36H51NO12/c1-9-37-16-33(17-42-3)23(39)13-24(45-6)36-20-14-34(41)25(46-7)15-35(49-18(2)38,27(30(36)37)28(47-8)29(33)36)26(20)31(34)48-32(40)19-10-11-21(43-4)22(12-19)44-5/h10-12,20,23-31,39,41H,9,13-17H2,1-8H3/t20-,23-,24+,25+,26-,27+,28+,29-,30-,31-,33+,34+,35-,36+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](OC(C)=O)([C@H]5[C@H]6OC(=O)c5ccc(OC)c(OC)c5)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C36H51NO12,pos_1_1proton,689.341126072,YVPYMQHYESYLIR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,3,7.5 354,7275,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,YVPYMQHYESYLIR-HZKWNRCISA-N,"InChI=1S/C36H51NO12/c1-9-37-16-33(17-42-3)23(39)13-24(45-6)36-20-14-34(41)25(46-7)15-35(49-18(2)38,27(30(36)37)28(47-8)29(33)36)26(20)31(34)48-32(40)19-10-11-21(43-4)22(12-19)44-5/h10-12,20,23-31,39,41H,9,13-17H2,1-8H3/t20-,23-,24+,25+,26-,27+,28+,29-,30-,31-,33+,34+,35-,36+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](OC(C)=O)([C@H]5[C@H]6OC(=O)c5ccc(OC)c(OC)c5)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C36H51NO12,pos_1_1proton,689.341126072,YVPYMQHYESYLIR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,3,7.5 355,7275,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,YVPYMQHYESYLIR-LQOPVHPFSA-N,"InChI=1S/C36H51NO12/c1-9-37-16-33(17-42-3)23(39)13-24(45-6)36-20-14-34(41)25(46-7)15-35(49-18(2)38,27(30(36)37)28(47-8)29(33)36)26(20)31(34)48-32(40)19-10-11-21(43-4)22(12-19)44-5/h10-12,20,23-31,39,41H,9,13-17H2,1-8H3/t20-,23-,24+,25+,26-,27-,28+,29+,30+,31+,33-,34+,35-,36-/m0/s1",CCN1C[C@@]2(COC)[C@H]3[C@H](OC)[C@H]4[C@@H]1[C@]3([C@H](OC)C[C@@H]2O)[C@H]1C[C@]2(O)[C@H](OC(=O)c3ccc(OC)c(OC)c3)[C@H]1[C@@]4(OC(C)=O)C[C@H]2OC,C36H51NO12,pos_1_1proton,689.341126072,YVPYMQHYESYLIR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ferox,1014250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ferox'],6,3,7.5 356,7273,551,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Furans,0.0,MS1_match,NOEGNKMFWQHSLB-UHFFFAOYSA-N,"InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2",O=Cc1ccc(CO)o1,C6H6O3,pos_1_1proton,126.031694052,NOEGNKMFWQHSLB,Polyketides,Cyclic polyketides,Furans,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 357,7269,-1,,,,0.0,MS1_match,PGHRFWJRZHZTQN-UHFFFAOYSA-N,"InChI=1S/C59H106O26/c1-26(61)18-27(62)19-28(63)20-29(64)21-33(66)38(68)40(70)42(72)44(74)46(76)48(78)50(80)52(82)51(81)49(79)47(77)45(75)43(73)41(71)39(69)34(67)22-30(65)24-85-37-11-12-55(4)35(56(37,5)25-60)10-13-58(7)36(55)9-8-31-32-23-54(2,3)14-16-59(32,53(83)84)17-15-57(31,58)6/h8,26-30,32-52,60-82H,9-25H2,1-7H3,(H,83,84)",CC(O)CC(O)CC(O)CC(O)CC(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)CC(O)COC1CCC2(C)C(CCC3(C)C2CC=C2C4CC(C)(C)CCC4(C(=O)O)CCC23C)C1(C)CO,C59H106O26,pos_2_2sodium,1230.697233512,PGHRFWJRZHZTQN,,,,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 358,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 359,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 360,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 361,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 362,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 363,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 364,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 365,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 366,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_1proton,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 367,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 368,7268,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 369,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Aristolochia mollissima,656355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia mollissima'],4,1,5.506898999214172 370,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,1,5.506898999214172 371,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Platostoma palustre,285422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Platostoma'],['Platostoma chinense'],4,1,5.506898999214172 372,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Spinacia oleracea,317784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Anserineae'],['Spinacia'],['Spinacia oleracea'],4,1,5.506898999214172 373,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Olea europaea,23729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Oleeae'],['Olea'],['Olea europaea'],4,1,5.506898999214172 374,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,1,5.506898999214172 375,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Euchresta formosana,280933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Euchresta'],['Euchresta formosana'],4,1,5.506898999214172 376,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Tapura fischeri,204812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Dichapetalaceae'],['Unknown'],['Tapura'],['Tapura fischeri'],4,1,5.506898999214172 377,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Saussurea medusa,474462.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea medusa'],4,1,5.506898999214172 378,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Alloberberis fremontii,725518.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fremontii'],4,1,5.506898999214172 379,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ophiorrhiza pumila,608350.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Ophiorrhizeae'],['Ophiorrhiza'],['Ophiorrhiza pumila'],4,1,5.506898999214172 380,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliata,5503578.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifolia'],4,1,5.506898999214172 381,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliolata,840498.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifoliolata'],4,1,5.506898999214172 382,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Phellodendron chinense,710068.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Phellodendron'],['Phellodendron chinense'],4,1,5.506898999214172 383,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ajuga taiwanensis,367347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Ajuga'],['Ajuga taiwanensis'],4,1,5.506898999214172 384,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Isotrema kaempferi,656366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia kaempferi'],4,1,5.506898999214172 385,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Aristolochia kaempferi,656366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia kaempferi'],4,1,5.506898999214172 386,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Centaurea malacitana,7613211.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Centaurea'],['Centaurea malacitana'],4,1,5.506898999214172 387,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Richardia grandiflora,3872538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Richardia'],['Richardia grandiflora'],4,1,5.506898999214172 388,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis fendleri,854435.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fendleri'],4,1,5.506898999214172 389,7267,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.25172475,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ocimum labiatum,588789.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Ocimum'],['Ocimum labiatum'],4,1,5.506898999214172 390,7264,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-UHFFFAOYSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3",CC12CC(OC1=O)C1(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C1C2,C30H46O3,pos_1_1proton1methanol,454.344695332,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,0,7.0 391,7264,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-YLXTXNMFSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3/t19-,20-,21+,22-,23-,26-,27+,28-,29+,30+/m0/s1",CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3CC=C4[C@@H]5C[C@@]6(C)C[C@H](OC6=O)[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12,C30H46O3,pos_1_1proton1methanol,454.3446953319999,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 392,7264,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-UHFFFAOYSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3",CC12CC(OC1=O)C1(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C1C2,C30H46O3,pos_1_1proton1methanol,454.344695332,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,0,7.0 393,7264,-1,,,,0.0,MS1_match,LAKBZOLMESAODV-BZFPBGGSSA-N,"InChI=1S/C31H50O4/c1-19(33)21-10-15-31(18-32)17-16-29(6)22(26(21)31)8-9-24-28(5)13-12-25(35-20(2)34)27(3,4)23(28)11-14-30(24,29)7/h21-26,32H,8-18H2,1-7H3/t21-,22+,23-,24+,25+,26+,28-,29+,30+,31+/m0/s1",CC(=O)O[C@@H]1CC[C@]2(C)[C@H]3CC[C@@H]4[C@H]5[C@H](C(C)=O)CC[C@]5(CO)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C,C31H50O4,pos_1_1proton,486.37091007999993,LAKBZOLMESAODV,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,0,7.0 394,7264,-1,,,,0.0,MS1_match,QRNHQHNHLDEWOS-BZFPBGGSSA-N,"InChI=1S/C31H50O4/c1-19(32)21-10-15-31(18-35-20(2)33)17-16-29(6)22(26(21)31)8-9-24-28(5)13-12-25(34)27(3,4)23(28)11-14-30(24,29)7/h21-26,34H,8-18H2,1-7H3/t21-,22+,23-,24+,25+,26+,28-,29+,30+,31+/m0/s1",CC(=O)OC[C@]12CC[C@@H](C(C)=O)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2,C31H50O4,pos_1_1proton,486.37091007999993,QRNHQHNHLDEWOS,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,0,7.0 395,7264,-1,,,,0.0,MS1_match,SLJTWDNVZKIDAU-SVAFSPIFSA-N,"InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O3,pos_1_1proton1methanol,454.3446953319999,SLJTWDNVZKIDAU,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,0,7.0 396,7264,-1,,,,0.0,MS1_match,SLJTWDNVZKIDAU-SVAFSPIFSA-N,"InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O3,pos_1_1proton1methanol,454.3446953319999,SLJTWDNVZKIDAU,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,0,7.0 397,7264,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-YLXTXNMFSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3/t19-,20-,21+,22-,23-,26-,27+,28-,29+,30+/m0/s1",CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3CC=C4[C@@H]5C[C@@]6(C)C[C@H](OC6=O)[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12,C30H46O3,pos_1_1proton1methanol,454.3446953319999,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 398,7262,31,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 399,7262,31,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 400,7262,31,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 401,7262,31,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 402,7260,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.9082541,ISDB,SBHXYTNGIZCORC-ZDUSSCGKSA-N,"InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2/t13-/m0/s1",O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c21,C15H12O6,,288.063388104,SBHXYTNGIZCORC,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,11.133016347885132 403,7257,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7977219,ISDB,KZNWWOXBZGCGSK-UHFFFAOYSA-N,"InChI=1S/C11H10O3/c1-13-5-9-6-14-7-11-8(4-12)2-3-10(9)11/h2-4,6-7H,5H2,1H3",COCc1cocc2c(C=O)ccc1-2,C11H10O3,,190.06299418,KZNWWOXBZGCGSK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,9.190887689590454 404,7254,140,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.39850438,ISDB,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,10.094017505645752 405,7251,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.810908,ISDB,GGGSEBXTKMTNBW-CQSZACIVSA-N,"InChI=1S/C16H17NO2/c18-15-9-12-6-7-17-14(13(12)10-16(15)19)8-11-4-2-1-3-5-11/h1-5,9-10,14,17-19H,6-8H2/t14-/m1/s1",Oc1cc2c(cc1O)[C@@H](Cc1ccccc1)NCC2,C16H17NO2,,255.125928784,GGGSEBXTKMTNBW,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Portulaca oleracea,883494.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Portulacaceae'],['Unknown'],['Portulaca'],['Portulaca oleracea'],4,0,7.243632078170776 406,7250,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.22697395,ISDB,,,,,,,AXWBBSIHTKEQAG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9078958034515381 407,7249,380,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,0.27897826,ISDB,KQQJHYGPRJWZEY-LDICSKNTSA-N,"InChI=1S/C14H18O4/c1-7-6-12-11(8(2)14(17)18-12)5-4-10(7)13(16)9(3)15/h4,7,11-13,16H,2,5-6H2,1,3H3/t7-,11+,12+,13-/m0/s1",C=C1C(=O)O[C@@H]2C[C@H](C)C([C@@H](O)C(C)=O)=CC[C@H]12,C14H18O4,,250.120509056,KQQJHYGPRJWZEY,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,Dittrichia graveolens,3899100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Dittrichia'],['Dittrichia graveolens'],4,3,6.615913033485413 408,7246,-1,,,,0.36144698,ISDB,RPYOBVFUJCZQDA-MUFCHLESSA-N,"InChI=1S/C19H21NO5/c1-24-17-11-13(3-9-16(17)22)4-10-19(23)20-12-18(25-2)14-5-7-15(21)8-6-14/h3-11,18,21-22H,12H2,1-2H3,(H,20,23)/b10-4+/t18-/m0/s1",COc1cc(/C=C/C(=O)NC[C@H](OC)c2ccc(O)cc2)ccc1O,C19H21NO5,,343.141972772,RPYOBVFUJCZQDA,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Solanum nigrum,494831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum nigrum'],0,0,1.4457879066467285 409,7246,-1,,,,0.36144698,ISDB,RPYOBVFUJCZQDA-YDMXYTAQSA-N,"InChI=1S/C19H21NO5/c1-24-17-11-13(3-9-16(17)22)4-10-19(23)20-12-18(25-2)14-5-7-15(21)8-6-14/h3-11,18,21-22H,12H2,1-2H3,(H,20,23)/b10-4+/t18-/m1/s1",COc1cc(/C=C/C(=O)NC[C@@H](OC)c2ccc(O)cc2)ccc1O,C19H21NO5,,343.141972772,RPYOBVFUJCZQDA,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Isodon excisus,624040.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Isodon'],['Isodon excisus'],0,0,1.4457879066467285 410,7244,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.6501549,ISDB,,,,,,,LNKDQHNGMLFJHH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.6006195545196533 411,7243,-1,,,,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-N,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/t16-,17+,18+,19-,21?/m1/s1",[O-]c1cc(-c2[o+]c3cc(O)cc(O)c3cc2OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C21H20O11,pos_1_1proton,448.10056146,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 412,7241,810,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.3636054,ISDB,XXQZXARMTRVCHW-VSMYQFNNSA-N,"InChI=1S/C35H54O6/c1-20(2)21(3)10-11-22(4)25-14-15-32(8)26-12-13-27-33(9,30(38)39)28(40-23(5)36)18-29(41-24(6)37)35(27)19-34(26,35)17-16-31(25,32)7/h20,22,25-29H,3,10-19H2,1-2,4-9H3,(H,38,39)/t22-,25-,26+,27+,28+,29+,31-,32+,33+,34+,35-/m1/s1",C=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@](C)(C(=O)O)[C@@H](OC(C)=O)C[C@H](OC(C)=O)[C@@]45C[C@@]35CC[C@]12C)C(C)C,C35H54O6,,570.392039448,XXQZXARMTRVCHW,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Combretum quadrangulare,6119919.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Combretaceae'],['Unknown'],['Combretum'],['Combretum quadrangulare'],4,3,6.954421639442444 413,7238,957,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HTKODPPFQUGBMU-GQJRUFTLSA-N,"InChI=1S/C19H30O8/c1-9(20)25-11-7-8-17(5,24)19-14(22)12(16(3,4)27-19)13(26-10(2)21)15(23)18(11,19)6/h11-15,22-24H,7-8H2,1-6H3/t11-,12+,13-,14+,15-,17-,18-,19-/m0/s1",CC(=O)O[C@H]1[C@@H]2[C@@H](O)[C@@]3(OC2(C)C)[C@@](C)([C@@H](OC(C)=O)CC[C@]3(C)O)[C@H]1O,C19H30O8,pos_1_1proton1ammonium,386.1940679199999,HTKODPPFQUGBMU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,3,7.5 414,7238,957,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HTKODPPFQUGBMU-GQJRUFTLSA-N,"InChI=1S/C19H30O8/c1-9(20)25-11-7-8-17(5,24)19-14(22)12(16(3,4)27-19)13(26-10(2)21)15(23)18(11,19)6/h11-15,22-24H,7-8H2,1-6H3/t11-,12+,13-,14+,15-,17-,18-,19-/m0/s1",CC(=O)O[C@H]1[C@@H]2[C@@H](O)[C@@]3(OC2(C)C)[C@@](C)([C@@H](OC(C)=O)CC[C@]3(C)O)[C@H]1O,C19H30O8,pos_1_1proton1ammonium,386.1940679199999,HTKODPPFQUGBMU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,3,7.5 415,7235,205,Terpenoids,Octadecanoids,Abeoabietane diterpenoids,0.0,MS1_match,XMLSXPIVAXONDL-PLNGDYQASA-N,"InChI=1S/C11H16O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5H,3,6-8H2,1-2H3/b5-4-",CC/C=C\CC1=C(C)CCC1=O,C11H16O,pos_1_1proton,164.120115132,XMLSXPIVAXONDL,Fatty acids,Octadecanoids,Jasmonic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 416,7233,1196,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-N,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/t16-,17+,18+,19-,21?/m1/s1",[O-]c1cc(-c2[o+]c3cc(O)cc(O)c3cc2OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C21H20O11,pos_1_1proton,448.10056146,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 417,7233,1196,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-O,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17+,18+,19-,21?/m1/s1",OC[C@H]1OC(Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O,C21H21O11+,pos_1_1proton,449.10783791209,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caucasica,5746390.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caucasica'],7,3,8.5 418,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,3,9.992650508880615 419,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Gymnosporia montana,5513373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia montana'],6,3,9.992650508880615 420,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-SWLSCSKDSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Maytenus disticha,418523.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus disticha'],6,3,9.992650508880615 421,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,3,9.992650508880615 422,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Salacia reticulata,5750051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia reticulata'],6,3,9.992650508880615 423,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-UHFFFAOYSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2",Oc1cc(O)c2c(c1)OC(c1cc(O)c(O)c(O)c1)C(O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,3,9.992650508880615 424,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-SWLSCSKDSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,3,9.992650508880615 425,7232,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,3,9.992650508880615 426,7231,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,3,9.5 427,7226,-1,,,,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_1_1proton,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 428,7226,-1,,,,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_1_1proton,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 429,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 430,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,2,8.0 431,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,2,8.0 432,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 433,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 434,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 435,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 436,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 437,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,2,8.0 438,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 439,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 440,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 441,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 442,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 443,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,2,8.0 444,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,2,8.0 445,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 446,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 447,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 448,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 449,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,2,8.0 450,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,2,8.0 451,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 452,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,2,8.0 453,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,2,8.0 454,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 455,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 456,7222,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,2,8.0 457,7219,-1,,,,0.0,MS1_match,CAXLTZYEJPQCKD-SBQRELSASA-N,"InChI=1S/C33H40O21/c1-9-19(39)23(43)26(46)31(48-9)49-11-5-14(38)18-15(6-11)50-28(10-2-3-12(36)13(37)4-10)29(22(18)42)53-33-30(25(45)21(41)17(8-35)52-33)54-32-27(47)24(44)20(40)16(7-34)51-32/h2-6,9,16-17,19-21,23-27,30-41,43-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,30+,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083,CAXLTZYEJPQCKD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 458,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 459,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus rionii,593374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus rionii'],6,0,6.0 460,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus hederaceus,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,0,6.0 461,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,6.0 462,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sphaerospermus,1033259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sphaerospermus'],6,0,6.0 463,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis var. diffusus,5264025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,0,6.0 464,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-HUGNALTDSA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9?,16?,17?,19-,20+,21+,23-,24-,25?,26?,27?,28?,31+,32+,33-/m0/s1",CC1O[C@@H](OCC2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)cc(O)c4c3=O)C(O)C(O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus ololeucos,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,0,6.0 465,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis,491491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,0,6.0 466,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus penicillatus,492327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus penicillatus'],6,0,6.0 467,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus penicillatus,492327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus penicillatus'],6,0,6.0 468,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 469,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus hederaceus,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,0,6.0 470,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,6.0 471,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sphaerospermus,1033259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sphaerospermus'],6,0,6.0 472,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis var. diffusus,5264025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,0,6.0 473,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-HUGNALTDSA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9?,16?,17?,19-,20+,21+,23-,24-,25?,26?,27?,28?,31+,32+,33-/m0/s1",CC1O[C@@H](OCC2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)cc(O)c4c3=O)C(O)C(O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus ololeucos,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,0,6.0 474,7219,-1,,,,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_sodium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,0,6.0 475,7219,-1,,,,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_sodium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 476,7219,-1,,,,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_sodium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,0,6.0 477,7219,-1,,,,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_sodium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 478,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus rionii,593374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus rionii'],6,0,6.0 479,7219,-1,,,,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_sodium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis,491491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,0,6.0 480,7213,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.7859378,ISDB,YAUMQRQSSYMXKC-HVEZYOFPSA-N,"InChI=1S/C34H42O21/c1-10-20(39)23(42)26(45)32(50-10)49-9-18-30(54-33-27(46)24(43)21(40)17(8-35)52-33)25(44)28(47)34(53-18)55-31-22(41)19-14(38)6-12(36)7-16(19)51-29(31)11-3-4-13(37)15(5-11)48-2/h3-7,10,17-18,20-21,23-28,30,32-40,42-47H,8-9H2,1-2H3/t10-,17+,18+,20-,21+,23+,24-,25+,26+,27+,28+,30+,32+,33-,34-/m0/s1",COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)ccc1O,C34H42O21,,786.221858364,YAUMQRQSSYMXKC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Opuntia ficus-indica,396274.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Cactaceae'],['Unknown'],['Opuntia'],['Opuntia ficus-indica'],4,3,8.64375114440918 481,7211,-1,,,,0.0,MS1_match,UKSPRKDZNYSFRL-PXOCLKCNSA-N,"InChI=1S/C20H20O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17-26,28H,6H2/t12-,15+,17-,18?,19?,20+/m1/s1",O=C1c2c(O)cc(O)cc2OC(c2ccc(O)c(O)c2)C1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O,C20H20O11,pos_2MH,436.10056146,UKSPRKDZNYSFRL,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,0,6.0 482,7211,-1,,,,0.0,MS1_match,UKSPRKDZNYSFRL-PXOCLKCNSA-N,"InChI=1S/C20H20O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17-26,28H,6H2/t12-,15+,17-,18?,19?,20+/m1/s1",O=C1c2c(O)cc(O)cc2OC(c2ccc(O)c(O)c2)C1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O,C20H20O11,pos_2MH,436.10056146,UKSPRKDZNYSFRL,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,0,6.0 483,7209,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5286238,ISDB,CMXCLTFHXRTSPB-WIXFNSMHSA-N,"InChI=1S/C30H44O2/c1-18(2)9-7-10-19(3)23-14-22-16-30(25(23)13-21(22)5)26-15-24-20(4)11-8-12-29(24,6)17-27(26)32-28(30)31/h9,13,15,19-20,22-23,25-27H,7-8,10-12,14,16-17H2,1-6H3/t19-,20-,22+,23-,25-,26-,27+,29+,30-/m0/s1",CC(C)=CCC[C@H](C)[C@@H]1C[C@@H]2C[C@]3(C(=O)O[C@@H]4C[C@@]5(C)CCC[C@H](C)C5=C[C@@H]43)[C@H]1C=C2C,C30H44O2,,436.334130648,CMXCLTFHXRTSPB,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Helenium autumnale,483908.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Helenium'],['Helenium autumnale'],4,2,7.114495277404785 484,7208,549,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,0.0,MS1_match,JXSVIVRDWWRQRT-UHFFFAOYSA-N,"InChI=1S/C30H48O5/c1-17-9-12-30(25(34)35)14-13-28(5)19(23(30)18(17)2)7-8-22-26(3)15-20(32)24(33)27(4,16-31)21(26)10-11-29(22,28)6/h7,17-18,20-24,31-33H,8-16H2,1-6H3,(H,34,35)",CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1C,C30H48O5,pos_1_1proton1ammonium,488.350174636,JXSVIVRDWWRQRT,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,3,7.5 485,7208,549,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,0.0,MS1_match,JXSVIVRDWWRQRT-UHFFFAOYSA-N,"InChI=1S/C30H48O5/c1-17-9-12-30(25(34)35)14-13-28(5)19(23(30)18(17)2)7-8-22-26(3)15-20(32)24(33)27(4,16-31)21(26)10-11-29(22,28)6/h7,17-18,20-24,31-33H,8-16H2,1-6H3,(H,34,35)",CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1C,C30H48O5,pos_1_1proton1ammonium,488.350174636,JXSVIVRDWWRQRT,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,3,7.5 486,7207,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.35148275,ISDB,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,2,8.405930995941162 487,7207,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.35148275,ISDB,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana officinalis var. latifolia,430697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.405930995941162 488,7207,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.35148275,ISDB,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.405930995941162 489,7205,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.41002455,ISDB,OZOLQBVPEIWKPL-ARJAWSKDSA-N,"InChI=1S/C22H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h1,3-4,23H,5-8,11-14,17-19,22H2/b4-3-",C#C/C=C\CCCCC#CCCCCC#CCCCC#CCO,C22H28O,,308.214015516,OZOLQBVPEIWKPL,Fatty acids,Fatty acyls,Fatty alcohols,Callyspongia,1031750.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Haplosclerida'],['Callyspongiidae'],['Unknown'],['Callyspongia'],['Unknown'],0,0,1.640098214149475 490,7204,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.7420103,ISDB,JDVDGNAHTZMMBI-UHFFFAOYSA-N,"InChI=1S/C21H36O3/c1-5-7-8-9-10-11-12-13-14-15-16-19-17(3)20(22)18(6-2)21(23-4)24-19/h5-16H2,1-4H3",CCCCCCCCCCCCc1oc(OC)c(CC)c(=O)c1C,C21H36O3,,336.266445012,JDVDGNAHTZMMBI,Polyketides,Cyclic polyketides,4-pyrone derivatives,Podolepis rugata,24091.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Podolepis'],['Podolepis rugata'],4,1,7.468041181564331 491,7202,-1,,,,0.26176944,ISDB,OOTNKTPCQZXBMI-UHFFFAOYSA-N,"InChI=1S/C18H16O4/c1-4-11-7-13-10-15(22-18(13)17(8-11)21-3)12-5-6-14(19)16(9-12)20-2/h4-10,19H,1H2,2-3H3",C=Cc1cc(OC)c2oc(-c3ccc(O)c(OC)c3)cc2c1,C18H16O4,,296.10485899199995,OOTNKTPCQZXBMI,Shikimates and Phenylpropanoids,Lignans,,Litsea acutivena,18346.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Litsea'],['Litsea acutivena'],4,0,5.047077775001526 492,7201,-1,,,,0.51502806,ISDB,OYEWMEUDOVKFPP-UHFFFAOYSA-N,"InChI=1S/C23H28O7/c1-4-5-6-7-8-9-15-11-16(29-3)12-19(25)21(15)23(28)30-17-10-14(2)20(22(26)27)18(24)13-17/h10-13,24-25H,4-9H2,1-3H3,(H,26,27)",CCCCCCCc1cc(OC)cc(O)c1C(=O)Oc1cc(C)c(C(=O)O)c(O)c1,C23H28O7,,416.183503236,OYEWMEUDOVKFPP,Polyketides,Aromatic polyketides,Depsides,Dimelaena oreina,730644.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Teloschistales'],['Physciaceae'],['Unknown'],['Dimelaena'],['Dimelaena oreina'],1,0,3.060112237930298 493,7197,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.25738263,ISDB,LBJNLIBZUVWVTE-UHFFFAOYSA-N,"InChI=1S/C21H28O6/c1-9(2)10-13(22)11-12(15(24)14(10)23)21-8-6-7-20(3,4)18(21)17(16(11)26-5)27-19(21)25/h9,16-18,22-24H,6-8H2,1-5H3",COC1c2c(O)c(C(C)C)c(O)c(O)c2C23CCCC(C)(C)C2C1OC3=O,C21H28O6,,376.188588616,LBJNLIBZUVWVTE,Terpenoids,Diterpenoids,Abietane diterpenoids,Rosmarinus officinalis,778824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia rosmarinus'],4,1,5.5295305252075195 494,7197,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.25738263,ISDB,LBJNLIBZUVWVTE-NYUBLWNDSA-N,"InChI=1S/C21H28O6/c1-9(2)10-13(22)11-12(15(24)14(10)23)21-8-6-7-20(3,4)18(21)17(16(11)26-5)27-19(21)25/h9,16-18,22-24H,6-8H2,1-5H3/t16-,17+,18-,21-/m0/s1",CO[C@H]1c2c(O)c(C(C)C)c(O)c(O)c2[C@@]23CCCC(C)(C)[C@@H]2[C@@H]1OC3=O,C21H28O6,,376.188588616,LBJNLIBZUVWVTE,Terpenoids,Diterpenoids,Abietane diterpenoids,Salvia,374096.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Unknown'],4,1,5.5295305252075195 495,7194,644,,,,0.57851356,ISDB,,,,,,,YHNAVOZOZMSWJG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.314054250717163 496,7193,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,NGYOKRAMXZLLQJ-FXNOOZBWSA-N,"InChI=1S/C32H50O18/c1-12(2)5-17(34)46-11-32(42)20-19(27-28(32)50-27)14(8-43-29(20)49-18(35)6-13(3)4)9-44-30-26(41)24(39)22(37)16(48-30)10-45-31-25(40)23(38)21(36)15(7-33)47-31/h8,12-13,15-16,19-31,33,36-42H,5-7,9-11H2,1-4H3/t15-,16+,19-,20-,21-,22+,23+,24-,25-,26+,27+,28+,29+,30+,31-,32-/m1/s1",CC(C)CC(=O)OC[C@@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(CO[C@H]3O[C@@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H]2[C@@H]2O[C@@H]21,C32H50O18,pos_2_1proton1sodium,722.29971476,NGYOKRAMXZLLQJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,2,7.0 497,7193,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,NGYOKRAMXZLLQJ-FXNOOZBWSA-N,"InChI=1S/C32H50O18/c1-12(2)5-17(34)46-11-32(42)20-19(27-28(32)50-27)14(8-43-29(20)49-18(35)6-13(3)4)9-44-30-26(41)24(39)22(37)16(48-30)10-45-31-25(40)23(38)21(36)15(7-33)47-31/h8,12-13,15-16,19-31,33,36-42H,5-7,9-11H2,1-4H3/t15-,16+,19-,20-,21-,22+,23+,24-,25-,26+,27+,28+,29+,30+,31-,32-/m1/s1",CC(C)CC(=O)OC[C@@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(CO[C@H]3O[C@@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H]2[C@@H]2O[C@@H]21,C32H50O18,pos_2_1proton1sodium,722.29971476,NGYOKRAMXZLLQJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 498,7192,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,OEVPPNBQSYOUCV-HXTWUXIJSA-N,"InChI=1S/C27H41ClO11/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(37-17(7)29)27(23,34)13-28/h12,14-16,19,22-23,25,33-34H,8-11,13H2,1-7H3/t19-,22-,23-,25-,26-,27-/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)[C@@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@]1(O)CCl,C27H41ClO11,pos_1_1proton1dmso,576.233739812,OEVPPNBQSYOUCV,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 499,7192,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,OEVPPNBQSYOUCV-PXKJKYEHSA-N,"InChI=1S/C27H41ClO11/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(37-17(7)29)27(23,34)13-28/h12,14-16,19,22-23,25,33-34H,8-11,13H2,1-7H3/t19-,22+,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)CCl,C27H41ClO11,pos_1_1proton1dmso,576.233739812,OEVPPNBQSYOUCV,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 500,7190,507,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.35237202,ISDB,TVFBTTNICRJUHG-NXXWKTOVSA-N,"InChI=1S/C29H38O12/c1-13(30)38-18(12-19(32)37-7)27(5)15-8-9-26(4)21(14-10-20(33)39-23(14)34)40-24(35)22-29(26,41-22)28(15,6)17(31)11-16(27)25(2,3)36/h10,15-16,18,20-22,33,36H,8-9,11-12H2,1-7H3/t15-,16+,18+,20+,21+,22-,26+,27-,28+,29-/m1/s1",COC(=O)C[C@H](OC(C)=O)[C@]1(C)[C@H]2CC[C@@]3(C)[C@H](C4=C[C@@H](O)OC4=O)OC(=O)[C@H]4O[C@]43[C@]2(C)C(=O)C[C@H]1C(C)(C)O,C29H38O12,,578.236326656,TVFBTTNICRJUHG,Terpenoids,Triterpenoids,Limonoids,Citrus sudachi,83857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus sudachi'],4,1,5.909488081932068 501,7190,507,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.35237202,ISDB,TVFBTTNICRJUHG-NXXWKTOVSA-N,"InChI=1S/C29H38O12/c1-13(30)38-18(12-19(32)37-7)27(5)15-8-9-26(4)21(14-10-20(33)39-23(14)34)40-24(35)22-29(26,41-22)28(15,6)17(31)11-16(27)25(2,3)36/h10,15-16,18,20-22,33,36H,8-9,11-12H2,1-7H3/t15-,16+,18+,20+,21+,22-,26+,27-,28+,29-/m1/s1",COC(=O)C[C@H](OC(C)=O)[C@]1(C)[C@H]2CC[C@@]3(C)[C@H](C4=C[C@@H](O)OC4=O)OC(=O)[C@H]4O[C@]43[C@]2(C)C(=O)C[C@H]1C(C)(C)O,C29H38O12,,578.236326656,TVFBTTNICRJUHG,Terpenoids,Triterpenoids,Limonoids,Citrus medica,798604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus medica'],4,1,5.909488081932068 502,7190,507,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.35237202,ISDB,TVFBTTNICRJUHG-NXXWKTOVSA-N,"InChI=1S/C29H38O12/c1-13(30)38-18(12-19(32)37-7)27(5)15-8-9-26(4)21(14-10-20(33)39-23(14)34)40-24(35)22-29(26,41-22)28(15,6)17(31)11-16(27)25(2,3)36/h10,15-16,18,20-22,33,36H,8-9,11-12H2,1-7H3/t15-,16+,18+,20+,21+,22-,26+,27-,28+,29-/m1/s1",COC(=O)C[C@H](OC(C)=O)[C@]1(C)[C@H]2CC[C@@]3(C)[C@H](C4=C[C@@H](O)OC4=O)OC(=O)[C@H]4O[C@]43[C@]2(C)C(=O)C[C@H]1C(C)(C)O,C29H38O12,,578.236326656,TVFBTTNICRJUHG,Terpenoids,Triterpenoids,Limonoids,Citrus medica var. sarcodactylis,321680.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus medica'],4,1,5.909488081932068 503,7188,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.40095285,ISDB,XOGGREZGCFWEBP-KHYBMMPHSA-N,"InChI=1S/C25H28O12/c1-2-13-14-7-8-33-23(32)15(14)11-34-24(13)37-25-21(31)22(20(30)18(10-26)35-25)36-19(29)6-4-12-3-5-16(27)17(28)9-12/h2-6,9,11,13-14,18,20-22,24-28,30-31H,1,7-8,10H2/b6-4+/t13-,14+,18-,20-,21-,22+,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](OC(=O)/C=C/c3ccc(O)c(O)c3)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C25H28O12,,520.158076336,XOGGREZGCFWEBP,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Neolamarckia cadamba,919146.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Neolamarckia'],['Neolamarckia cadamba'],4,3,7.1038113832473755 504,7188,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.40095285,ISDB,XOGGREZGCFWEBP-KHYBMMPHSA-N,"InChI=1S/C25H28O12/c1-2-13-14-7-8-33-23(32)15(14)11-34-24(13)37-25-21(31)22(20(30)18(10-26)35-25)36-19(29)6-4-12-3-5-16(27)17(28)9-12/h2-6,9,11,13-14,18,20-22,24-28,30-31H,1,7-8,10H2/b6-4+/t13-,14+,18-,20-,21-,22+,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](OC(=O)/C=C/c3ccc(O)c(O)c3)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C25H28O12,,520.158076336,XOGGREZGCFWEBP,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Neonauclea purpurea,966697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Breonia'],['Breonia chinensis'],4,3,7.1038113832473755 505,7188,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.40095285,ISDB,XOGGREZGCFWEBP-UHFFFAOYSA-N,"InChI=1S/C25H28O12/c1-2-13-14-7-8-33-23(32)15(14)11-34-24(13)37-25-21(31)22(20(30)18(10-26)35-25)36-19(29)6-4-12-3-5-16(27)17(28)9-12/h2-6,9,11,13-14,18,20-22,24-28,30-31H,1,7-8,10H2",C=CC1C(OC2OC(CO)C(O)C(OC(=O)C=Cc3ccc(O)c(O)c3)C2O)OC=C2C(=O)OCCC21,C25H28O12,,520.158076336,XOGGREZGCFWEBP,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Breonia chinensis,966697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Breonia'],['Breonia chinensis'],4,3,7.1038113832473755 506,7185,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.54814655,ISDB,OMHJQGZJZUFMMT-AJHRVBBASA-N,"InChI=1S/C27H34O3/c28-19-11-8-17(9-12-19)6-4-2-1-3-5-7-20-21-14-15-22-23(27(29)30)13-10-18-16-24(20)26(21)25(18)22/h8-15,18,20-26,28H,1-7,16H2,(H,29,30)/t18-,20-,21-,22+,23-,24+,25-,26-/m1/s1",O=C(O)[C@@H]1C=C[C@@H]2C[C@H]3[C@H](CCCCCCCc4ccc(O)cc4)[C@H]4C=C[C@@H]1[C@@H]2[C@H]43,C27H34O3,,406.250794948,OMHJQGZJZUFMMT,,,,Beilschmiedia ferruginea,6025446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Beilschmiedia'],['Beilschmiedia ferruginea'],4,0,6.192586183547974 507,7183,-1,,,,0.2980617,ISDB,QGINILJTTLZGAD-ILOGMZITSA-N,"InChI=1S/C25H40O11/c1-13-8-15(27)9-24(3,4)16(13)7-6-14(2)34-23-21(32)22(20(31)17(12-26)35-23)36-19(30)11-25(5,33)10-18(28)29/h8,14,16-17,20-23,26,31-33H,6-7,9-12H2,1-5H3,(H,28,29)/t14-,16-,17-,20-,21-,22+,23-,25+/m1/s1",CC1=CC(=O)CC(C)(C)[C@@H]1CC[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)C[C@@](C)(O)CC(=O)O)[C@H]1O,C25H40O11,,516.2570621,QGINILJTTLZGAD,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Allium ampeloprasum,748378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium ampeloprasum'],4,0,5.192246794700623 508,7183,-1,,,,0.2980617,ISDB,QGINILJTTLZGAD-ILOGMZITSA-N,"InChI=1S/C25H40O11/c1-13-8-15(27)9-24(3,4)16(13)7-6-14(2)34-23-21(32)22(20(31)17(12-26)35-23)36-19(30)11-25(5,33)10-18(28)29/h8,14,16-17,20-23,26,31-33H,6-7,9-12H2,1-5H3,(H,28,29)/t14-,16-,17-,20-,21-,22+,23-,25+/m1/s1",CC1=CC(=O)CC(C)(C)[C@@H]1CC[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)C[C@@](C)(O)CC(=O)O)[C@H]1O,C25H40O11,,516.2570621,QGINILJTTLZGAD,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Allium obliquum,34203.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium obliquum'],4,0,5.192246794700623 509,7183,-1,,,,0.2980617,ISDB,QGINILJTTLZGAD-ILOGMZITSA-N,"InChI=1S/C25H40O11/c1-13-8-15(27)9-24(3,4)16(13)7-6-14(2)34-23-21(32)22(20(31)17(12-26)35-23)36-19(30)11-25(5,33)10-18(28)29/h8,14,16-17,20-23,26,31-33H,6-7,9-12H2,1-5H3,(H,28,29)/t14-,16-,17-,20-,21-,22+,23-,25+/m1/s1",CC1=CC(=O)CC(C)(C)[C@@H]1CC[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)C[C@@](C)(O)CC(=O)O)[C@H]1O,C25H40O11,,516.2570621,QGINILJTTLZGAD,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Allium porrum,748378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium ampeloprasum'],4,0,5.192246794700623 510,7174,-1,,,,0.40188953,ISDB,,,,,,,FPBYTAJRKRENOD,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6075581312179565 511,7170,-1,,,,0.0,MS1_match,HKNBJSRIYRDSLB-UHFFFAOYSA-N,"InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C33H40O20,pos_1_sodium,756.21129368,HKNBJSRIYRDSLB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 512,7170,-1,,,,0.0,MS1_match,HKNBJSRIYRDSLB-MIORVHIISA-N,"InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.21129368,HKNBJSRIYRDSLB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 513,7170,-1,,,,0.0,MS1_match,HKNBJSRIYRDSLB-MIORVHIISA-N,"InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.21129368,HKNBJSRIYRDSLB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,6.0 514,7170,-1,,,,0.0,MS1_match,HKNBJSRIYRDSLB-UHFFFAOYSA-N,"InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C33H40O20,pos_1_sodium,756.21129368,HKNBJSRIYRDSLB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 515,7170,-1,,,,0.0,MS1_match,HKNBJSRIYRDSLB-MIORVHIISA-N,"InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.21129368,HKNBJSRIYRDSLB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 516,7170,-1,,,,0.0,MS1_match,HKNBJSRIYRDSLB-MIORVHIISA-N,"InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.21129368,HKNBJSRIYRDSLB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,6.0 517,7170,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 518,7170,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 519,7170,-1,,,,0.0,MS1_match,VRYWDBDPXMHHGE-HRPPYHBASA-N,"InChI=1S/C33H40O20/c1-10-19(38)23(42)26(45)31(47-10)48-13-6-14(37)18-15(7-13)49-28(11-2-4-12(36)5-3-11)29(22(18)41)52-33-30(25(44)21(40)17(9-35)51-33)53-32-27(46)24(43)20(39)16(8-34)50-32/h2-7,10,16-17,19-21,23-27,30-40,42-46H,8-9H2,1H3/t10-,16+,17+,19-,20+,21-,23+,24-,25-,26+,27+,30+,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.21129368,VRYWDBDPXMHHGE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella damascena,387814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella damascena'],6,0,6.0 520,7166,-1,,,,0.0,MS1_match,GZSOSUNBTXMUFQ-UHFFFAOYSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3",COc1ccc(-c2cc(=O)c3c(O)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3o2)cc1O,C28H32O15,pos_1_sodium,608.174120324,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,0,6.0 521,7166,-1,,,,0.0,MS1_match,GZSOSUNBTXMUFQ-CYZBKYQRSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C28H32O15,pos_1_sodium,608.1741203239999,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia caucasica,994163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia caucasica'],6,0,6.0 522,7166,-1,,,,0.0,MS1_match,GZSOSUNBTXMUFQ-UHFFFAOYSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3",COc1ccc(-c2cc(=O)c3c(O)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3o2)cc1O,C28H32O15,pos_1_sodium,608.174120324,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,0,6.0 523,7166,-1,,,,0.0,MS1_match,GZSOSUNBTXMUFQ-CYZBKYQRSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C28H32O15,pos_1_sodium,608.1741203239999,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia caucasica,994163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia caucasica'],6,0,6.0 524,7166,-1,,,,0.0,MS1_match,VCCNKWWXYVWTLT-CYZBKYQRSA-N,"InChI=1S/C28H32O15/c1-10-21(33)23(35)25(37)27(39-10)43-26-24(36)22(34)19(9-29)42-28(26)40-12-6-14(31)20-15(32)8-17(41-18(20)7-12)11-3-4-16(38-2)13(30)5-11/h3-8,10,19,21-31,33-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3o2)cc1O,C28H32O15,pos_1_sodium,608.174120324,VCCNKWWXYVWTLT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 525,7166,-1,,,,0.0,MS1_match,SWZFUPSKOHNPFU-JUHWEFMQSA-N,"InChI=1S/C28H32O15/c1-39-18-11-14(5-9-17(18)41-26-23(34)22(33)21(32)19(13-29)42-26)6-10-20(31)43-28(27(37)38,24(35)25(36)40-2)12-15-3-7-16(30)8-4-15/h3-11,19,21-24,26,29-30,32-35H,12-13H2,1-2H3,(H,37,38)/b10-6+/t19-,21-,22+,23-,24?,26-,28?/m1/s1",COC(=O)C(O)C(Cc1ccc(O)cc1)(OC(=O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1)C(=O)O,C28H32O15,pos_1_sodium,608.174120324,SWZFUPSKOHNPFU,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 526,7165,-1,,,,0.0,MS1_match,XNIDEUYQVRRKJJ-FZPNTLRJSA-N,"InChI=1S/C35H34O18/c1-15(36)44-14-27-31(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(52-27)53-32-29(43)28-25(47-18(4)39)12-24(46-17(3)38)13-26(28)51-30(32)22-8-10-23(11-9-22)45-16(2)37/h8-13,27,31,33-35H,14H2,1-7H3/t27-,31-,33+,34-,35+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(OC(C)=O)cc3)oc3cc(OC(C)=O)cc(OC(C)=O)c3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C35H34O18,pos_2_2proton,742.1745142480002,XNIDEUYQVRRKJJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 527,7165,-1,,,,0.0,MS1_match,XNIDEUYQVRRKJJ-FZPNTLRJSA-N,"InChI=1S/C35H34O18/c1-15(36)44-14-27-31(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(52-27)53-32-29(43)28-25(47-18(4)39)12-24(46-17(3)38)13-26(28)51-30(32)22-8-10-23(11-9-22)45-16(2)37/h8-13,27,31,33-35H,14H2,1-7H3/t27-,31-,33+,34-,35+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(OC(C)=O)cc3)oc3cc(OC(C)=O)cc(OC(C)=O)c3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C35H34O18,pos_2_2proton,742.1745142480002,XNIDEUYQVRRKJJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 528,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,BRYZTZMVXZZLPD-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_sodium,462.116211524,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,3,7.5 529,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,RMBWMWQXPGWZJZ-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3",COc1ccc(-c2cc(=O)c3c(O)c(OC4OC(CO)C(O)C(O)C4O)c(O)cc3o2)cc1,C22H22O11,pos_1_sodium,462.116211524,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,3,7.5 530,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,RMBWMWQXPGWZJZ-GSVZXUNASA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3/t15-,17-,19+,20-,22+/m1/s1",COc1ccc(-c2cc(=O)c3c(O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)cc1,C22H22O11,pos_1_sodium,462.1162115239998,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,3,7.5 531,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,RMBWMWQXPGWZJZ-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3",COc1ccc(-c2cc(=O)c3c(O)c(OC4OC(CO)C(O)C(O)C4O)c(O)cc3o2)cc1,C22H22O11,pos_1_sodium,462.116211524,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,3,7.5 532,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,BRYZTZMVXZZLPD-PGPONNFDSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_sodium,462.1162115239999,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,3,7.5 533,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,BRYZTZMVXZZLPD-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_sodium,462.116211524,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,3,7.5 534,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,BRYZTZMVXZZLPD-PGPONNFDSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_sodium,462.1162115239999,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,3,7.5 535,7159,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,RMBWMWQXPGWZJZ-GSVZXUNASA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3/t15-,17-,19+,20-,22+/m1/s1",COc1ccc(-c2cc(=O)c3c(O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)cc1,C22H22O11,pos_1_sodium,462.1162115239998,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,3,7.5 536,7157,-1,,,,0.74123,ISDB,LUZSWWYKKLTDHU-UHFFFAOYSA-N,"InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)",CCCCCC=CC=CC(=O)CCCCCCCC(=O)O,C18H30O3,,294.21949482,LUZSWWYKKLTDHU,,,,Artemisia argyi,915618.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia argyi'],4,0,6.9649200439453125 537,7157,-1,,,,0.74123,ISDB,LUZSWWYKKLTDHU-UHFFFAOYSA-N,"InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)",CCCCCC=CC=CC(=O)CCCCCCCC(=O)O,C18H30O3,,294.21949482,LUZSWWYKKLTDHU,,,,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,6.9649200439453125 538,7157,-1,,,,0.74123,ISDB,LUZSWWYKKLTDHU-UHFFFAOYSA-N,"InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)",CCCCCC=CC=CC(=O)CCCCCCCC(=O)O,C18H30O3,,294.21949482,LUZSWWYKKLTDHU,,,,Galeopsis bifida,391749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Galeopsis'],['Galeopsis bifida'],4,0,6.9649200439453125 539,7157,-1,,,,0.74123,ISDB,LUZSWWYKKLTDHU-UHFFFAOYSA-N,"InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)",CCCCCC=CC=CC(=O)CCCCCCCC(=O)O,C18H30O3,,294.21949482,LUZSWWYKKLTDHU,,,,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,0,6.9649200439453125 540,7155,810,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.22672935,ISDB,ABJXQXSTZIZQEY-MKSAJWOVSA-N,"InChI=1S/C34H50O7/c1-19(11-10-12-20(2)30(38)39)23-15-18-33(8)24-13-14-25-31(5,6)26(37)16-17-32(25,7)27(24)28(40-21(3)35)29(34(23,33)9)41-22(4)36/h12,19,23,25,28-29H,10-11,13-18H2,1-9H3,(H,38,39)/b20-12+/t19-,23-,25+,28-,29-,32+,33+,34+/m1/s1",CC(=O)O[C@@H]1C2=C(CC[C@H]3C(C)(C)C(=O)CC[C@]23C)[C@]2(C)CC[C@H]([C@H](C)CC/C=C(\C)C(=O)O)[C@@]2(C)[C@@H]1OC(C)=O,C34H50O7,,570.3556539399999,ABJXQXSTZIZQEY,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Pappia fissilis,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,2,1.90691739320755 541,7153,724,Fatty acids,Sphingolipids,Ceramides,0.20731613,ISDB,RNZAVYLVSMBVIV-MUPZXDJASA-N,"InChI=1S/C34H67NO7S/c1-29(2)24-20-16-12-8-6-5-7-9-14-18-22-26-32(36)31(28-42-43(39,40)41)35-34(38)33(37)27-23-19-15-11-10-13-17-21-25-30(3)4/h22,26,29-33,36-37H,5-21,23-25,27-28H2,1-4H3,(H,35,38)(H,39,40,41)/b26-22+/t31-,32+,33+/m0/s1",CC(C)CCCCCCCCCCC/C=C/[C@@H](O)[C@H](COS(=O)(=O)O)NC(=O)[C@H](O)CCCCCCCCCCC(C)C,C34H67NO7S,,633.463824484,RNZAVYLVSMBVIV,Fatty acids,Sphingolipids,Ceramides,Discodermia calyx,2839673.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Tetractinellida'],['Theonellidae'],['Unknown'],['Discodermia'],['Discodermia calyx'],1,3,3.329264521598816 542,7150,-1,,,,0.7428211,ISDB,,,,,,,YDNNMFNMJFYGRK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.9712843894958496 543,7149,-1,,,,0.20581667,ISDB,WCGUUGGRBIKTOS-GPOJBZKASA-N,"InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C30H48O3,,456.3603453959999,WCGUUGGRBIKTOS,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.823266685009003 544,7149,-1,,,,0.20581667,ISDB,WCGUUGGRBIKTOS-GPOJBZKASA-N,"InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C30H48O3,,456.3603453959999,WCGUUGGRBIKTOS,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,0,7.823266685009003 545,7148,1176,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,0.0,MS1_match,GUZAIURHRDPBKE-HIEJAJBWSA-N,"InChI=1S/C30H46O3/c1-17(2)18-9-12-22-29(18,7)25(33)16-28(6)19-10-11-21-26(3,4)23(31)13-14-27(21,5)20(19)15-24(32)30(22,28)8/h10,15,17-18,21-23,25,31,33H,9,11-14,16H2,1-8H3/t18-,21+,22-,23-,25-,27-,28-,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC(=O)[C@@]21C,C30H46O3,pos_1_1proton,454.344695332,GUZAIURHRDPBKE,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 546,7145,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton1methanol,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 547,7143,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.2489435,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliolata,840498.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifoliolata'],5,1,6.49577397108078 548,7143,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.2489435,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliata,5503578.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifolia'],5,1,6.49577397108078 549,7143,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.2489435,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis fendleri,854435.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fendleri'],5,1,6.49577397108078 550,7143,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.2489435,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Alloberberis fremontii,725518.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fremontii'],5,1,6.49577397108078 551,7141,-1,,,,0.37039867,ISDB,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,0,7.481594681739807 552,7141,-1,,,,0.37039867,ISDB,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,0,7.481594681739807 553,7141,-1,,,,0.37039867,ISDB,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,0,7.481594681739807 554,7141,-1,,,,0.37039867,ISDB,QBXRXORKIXERDE-QLYLRAMCSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40-,41+,42+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,7.481594681739807 555,7138,391,Alkaloids,Ornithine alkaloids,Polyamines,0.40312794,ISDB,,,,,,,ZOASRUGREWIJSO,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6125117540359497 556,7137,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.6929529,ISDB,SDJMNNDDHQWWJH-UXCAXZQLSA-N,"InChI=1S/C18H26O3/c1-16-6-5-14(20)8-12(16)4-7-17-9-13(2-3-15(16)17)18(21,10-17)11-19/h5-6,12-13,15,19,21H,2-4,7-11H2,1H3/t12-,13-,15+,16-,17+,18+/m1/s1",C[C@@]12C=CC(=O)C[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(CO)C3,C18H26O3,,290.188194692,SDJMNNDDHQWWJH,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Diplospora dubia,729058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora dubia'],4,3,8.271811485290527 557,7136,940,,,,0.53171355,ISDB,,,,,,,BIKJRUMCRBPQKR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.126854181289673 558,7131,-1,,,,0.34133855,ISDB,IATWXYMZKVGQLC-CGJGEUGISA-N,"InChI=1S/C21H24O6/c1-24-17-7-6-14(11-18(17)25-2)20-16(12-23)15-9-13(5-4-8-22)10-19(26-3)21(15)27-20/h4-7,9-11,16,20,22-23H,8,12H2,1-3H3/b5-4+/t16-,20+/m1/s1",COc1ccc([C@@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)cc1OC,C21H24O6,,372.157288488,IATWXYMZKVGQLC,Shikimates and Phenylpropanoids,Lignans,Neolignans,Bambusa emeiensis,452032.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Bambuseae'],['Bambusa'],['Bambusa emeiensis'],4,0,5.3653541803359985 559,7131,-1,,,,0.34133855,ISDB,IATWXYMZKVGQLC-WXVIEYATSA-N,"InChI=1S/C21H24O6/c1-24-17-7-6-14(11-18(17)25-2)20-16(12-23)15-9-13(5-4-8-22)10-19(26-3)21(15)27-20/h4-7,9-11,16,20,22-23H,8,12H2,1-3H3/b5-4+/t16-,20+/m0/s1",COc1ccc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@@H]2CO)cc1OC,C21H24O6,,372.1572884879999,IATWXYMZKVGQLC,Shikimates and Phenylpropanoids,Lignans,Neolignans,Anastatica hierochuntica,441964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Anastaticeae'],['Anastatica'],['Anastatica hierochuntica'],4,0,5.3653541803359985 560,7126,-1,,,,0.0,MS1_match,HTSYYNWISWGUIR-UHFFFAOYSA-N,"InChI=1S/C29H41NO6/c1-4-30-14-27(15-36-16-8-6-5-7-9-16)11-10-20(31)29-18-12-17-19(34-2)13-28(33,21(18)23(17)32)22(26(29)30)24(35-3)25(27)29/h5-9,17-26,31-33H,4,10-15H2,1-3H3",CCN1CC2(COc3ccccc3)CCC(O)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C29H41NO6,pos_1_1potassium,499.293388032,HTSYYNWISWGUIR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 561,7126,-1,,,,0.0,MS1_match,HTSYYNWISWGUIR-UHFFFAOYSA-N,"InChI=1S/C29H41NO6/c1-4-30-14-27(15-36-16-8-6-5-7-9-16)11-10-20(31)29-18-12-17-19(34-2)13-28(33,21(18)23(17)32)22(26(29)30)24(35-3)25(27)29/h5-9,17-26,31-33H,4,10-15H2,1-3H3",CCN1CC2(COc3ccccc3)CCC(O)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C29H41NO6,pos_1_1potassium,499.293388032,HTSYYNWISWGUIR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 562,7123,-1,,,,0.0,MS1_match,PGYAYSRVSAJXTE-CLONMANBSA-N,"InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35-36(5,6)25-33(41)27-38(35,9)43)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-21,23-24,33-34,41-43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t22?,33-,34-,38+,39+,40-/m0/s1",C/C(C=C=C1C(C)(C)C[C@H](O)C[C@@]1(C)O)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C,C40H56O4,pos_1_sodium,600.417860272,PGYAYSRVSAJXTE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Trollius europaeus,805006.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius europaeus'],6,0,6.0 563,7123,-1,,,,0.0,MS1_match,ZVKXPPXCNUMUOR-WYZRDEAWSA-N,"InChI=1S/C40H56O4/c1-28(17-13-18-30(3)21-22-35-37(5,6)24-32(41)26-39(35,9)43)15-11-12-16-29(2)19-14-20-31(4)34-23-36-38(7,8)25-33(42)27-40(36,10)44-34/h11-21,23,32-34,41-43H,24-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20-/t22?,32-,33-,34?,39+,40+/m0/s1",C/C(=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=C=C1C(C)(C)C[C@H](O)C[C@@]1(C)O)C1C=C2C(C)(C)C[C@H](O)C[C@@]2(C)O1,C40H56O4,pos_1_sodium,600.417860272,ZVKXPPXCNUMUOR,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Ranunculus acris,387818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus acris'],6,0,6.0 564,7123,-1,,,,0.0,MS1_match,IPEHJNRNYPOFII-UHFFFAOYSA-N,"InChI=1S/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-10,12,18,21H,6-8,11H2,1-5H3",CC(C)c1cc2c(cc1O)C1(C)CCCC(C)(C)C1CC2=O,C20H28O2,pos_2MNa,300.208930136,IPEHJNRNYPOFII,Terpenoids,Diterpenoids,Abietane diterpenoids,Delphinium cyphoplectrum,309504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cyphoplectrum'],6,0,6.0 565,7120,-1,,,,0.0,MS1_match,IUWMJMIMXOEDKV-UHFFFAOYSA-N,"InChI=1S/C20H22O8/c1-25-15-7-11(3-5-13(15)21)17-19(23)9-28-18(20(19,24)10-27-17)12-4-6-14(22)16(8-12)26-2/h3-8,17-18,21-24H,9-10H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(O)c(OC)c4)OCC23O)ccc1O,C20H22O8,pos_1_1proton1ammonium,390.131467664,IUWMJMIMXOEDKV,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 566,7120,-1,,,,0.0,MS1_match,IUWMJMIMXOEDKV-VNTMZGSJSA-N,"InChI=1S/C20H22O8/c1-25-15-7-11(3-5-13(15)21)17-19(23)9-28-18(20(19,24)10-27-17)12-4-6-14(22)16(8-12)26-2/h3-8,17-18,21-24H,9-10H2,1-2H3/t17-,18-,19+,20+/m0/s1",COc1cc([C@@H]2OC[C@@]3(O)[C@H](c4ccc(O)c(OC)c4)OC[C@@]23O)ccc1O,C20H22O8,pos_1_1proton1ammonium,390.1314676639999,IUWMJMIMXOEDKV,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 567,7120,-1,,,,0.0,MS1_match,IUWMJMIMXOEDKV-UHFFFAOYSA-N,"InChI=1S/C20H22O8/c1-25-15-7-11(3-5-13(15)21)17-19(23)9-28-18(20(19,24)10-27-17)12-4-6-14(22)16(8-12)26-2/h3-8,17-18,21-24H,9-10H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(O)c(OC)c4)OCC23O)ccc1O,C20H22O8,pos_1_1proton1ammonium,390.131467664,IUWMJMIMXOEDKV,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 568,7120,-1,,,,0.0,MS1_match,IUWMJMIMXOEDKV-UHFFFAOYSA-N,"InChI=1S/C20H22O8/c1-25-15-7-11(3-5-13(15)21)17-19(23)9-28-18(20(19,24)10-27-17)12-4-6-14(22)16(8-12)26-2/h3-8,17-18,21-24H,9-10H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(O)c(OC)c4)OCC23O)ccc1O,C20H22O8,pos_1_1proton1ammonium,390.131467664,IUWMJMIMXOEDKV,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 569,7120,-1,,,,0.0,MS1_match,IUWMJMIMXOEDKV-VNTMZGSJSA-N,"InChI=1S/C20H22O8/c1-25-15-7-11(3-5-13(15)21)17-19(23)9-28-18(20(19,24)10-27-17)12-4-6-14(22)16(8-12)26-2/h3-8,17-18,21-24H,9-10H2,1-2H3/t17-,18-,19+,20+/m0/s1",COc1cc([C@@H]2OC[C@@]3(O)[C@H](c4ccc(O)c(OC)c4)OC[C@@]23O)ccc1O,C20H22O8,pos_1_1proton1ammonium,390.1314676639999,IUWMJMIMXOEDKV,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 570,7120,-1,,,,0.0,MS1_match,IUWMJMIMXOEDKV-UHFFFAOYSA-N,"InChI=1S/C20H22O8/c1-25-15-7-11(3-5-13(15)21)17-19(23)9-28-18(20(19,24)10-27-17)12-4-6-14(22)16(8-12)26-2/h3-8,17-18,21-24H,9-10H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(O)c(OC)c4)OCC23O)ccc1O,C20H22O8,pos_1_1proton1ammonium,390.131467664,IUWMJMIMXOEDKV,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 571,7117,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.0,MS1_match,CVNWHGNSIXIBPG-GWKMRXIPSA-N,"InChI=1S/C20H24O5/c1-5-17(14-25-19(21)13-15(2)3)20(22)24-12-6-7-16-8-10-18(23-4)11-9-16/h5-11,13H,12,14H2,1-4H3/b7-6+,17-5-",C/C=C(/COC(=O)C=C(C)C)C(=O)OC/C=C/c1ccc(OC)cc1,C20H24O5,pos_1_1proton,344.162373868,CVNWHGNSIXIBPG,,,,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 572,7117,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.0,MS1_match,OOFFFDNFBGROFL-WYWILGHBSA-N,"InChI=1S/C20H24O5/c1-5-15(2)19(21)25-14-12-16(3)20(22)24-13-6-7-17-8-10-18(23-4)11-9-17/h5-12H,13-14H2,1-4H3/b7-6+,15-5-,16-12-",C/C=C(/C)C(=O)OC/C=C(/C)C(=O)OC/C=C/c1ccc(OC)cc1,C20H24O5,pos_1_1proton,344.162373868,OOFFFDNFBGROFL,,,,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 573,7117,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.0,MS1_match,KRXLVSZOLMEYHF-SUOLFYLESA-N,"InChI=1S/C20H24O5/c1-5-15(3)19(21)25-14-17(6-2)20(22)24-13-7-8-16-9-11-18(23-4)12-10-16/h5-12H,13-14H2,1-4H3/b8-7+,15-5-,17-6-",C/C=C(/C)C(=O)OC/C(=C/C)C(=O)OC/C=C/c1ccc(OC)cc1,C20H24O5,pos_1_1proton,344.162373868,KRXLVSZOLMEYHF,,,,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 574,7117,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.0,MS1_match,KRXLVSZOLMEYHF-UHFFFAOYSA-N,"InChI=1S/C20H24O5/c1-5-15(3)19(21)25-14-17(6-2)20(22)24-13-7-8-16-9-11-18(23-4)12-10-16/h5-12H,13-14H2,1-4H3",CC=C(C)C(=O)OCC(=CC)C(=O)OCC=Cc1ccc(OC)cc1,C20H24O5,pos_1_1proton,344.162373868,KRXLVSZOLMEYHF,,,,Cryptothladia chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 575,7115,-1,,,,0.51332873,ISDB,,,,,,,AHIHQZAXIJEHNI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.0533149242401123 576,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 577,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 578,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 579,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 580,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 581,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 582,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 583,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 584,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_sodium,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 585,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_sodium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 586,7113,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_sodium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 587,7108,308,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.0,MS1_match,ZHLKPTGZDJEYTJ-NWAJYRGSSA-N,"InChI=1S/C30H44O6/c1-15-12-16-22(25(4,5)34)36-30(35-16)21(15)27(7)20(32)13-29-14-28(29)11-10-19(31)24(2,3)17(28)8-9-18(29)26(27,6)23(30)33/h10-11,15-18,20-23,32-34H,8-9,12-14H2,1-7H3/t15-,16-,17+,18+,20-,21-,22+,23-,26-,27-,28-,29+,30+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@@H]4CC[C@H]5C(C)(C)C(=O)C=C[C@@]56C[C@@]46C[C@@H](O)[C@]2(C)[C@@H]13,C30H44O6,pos_1_1proton1methanol,500.313789128,ZHLKPTGZDJEYTJ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea yunnanensis,512689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea yunnanensis'],6,3,7.5 588,7106,167,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.25965098,ISDB,PFUZNBJKDVPHJT-ZJOBFFGXSA-N,"InChI=1S/C17H24O4/c1-10(18)21-13-7-8-17(4)12(16(13,2)3)6-5-11-9-20-15(19)14(11)17/h5,12-14H,6-9H2,1-4H3/t12-,13-,14+,17-/m0/s1",CC(=O)O[C@H]1CC[C@]2(C)[C@H]3C(=O)OCC3=CC[C@H]2C1(C)C,C17H24O4,,292.167459248,PFUZNBJKDVPHJT,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,Drimys winteri,777325.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Canellales'],['Winteraceae'],['Unknown'],['Drimys'],['Drimys winteri'],4,3,6.538603901863098 589,7096,-1,,,,0.0,MS1_match,ODJLBQGVINUMMR-HZXDTFASSA-N,"InChI=1S/C23H32O6/c1-20-6-3-17-18(4-8-22(27)11-15(25)2-7-21(17,22)13-24)23(20,28)9-5-16(20)14-10-19(26)29-12-14/h10,13,15-18,25,27-28H,2-9,11-12H2,1H3/t15-,16+,17-,18+,20+,21-,22-,23-/m0/s1",C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C23H32O6,pos_1_1proton,404.2198887439999,ODJLBQGVINUMMR,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 590,7096,-1,,,,0.0,MS1_match,ODJLBQGVINUMMR-UHFFFAOYSA-N,"InChI=1S/C23H32O6/c1-20-6-3-17-18(4-8-22(27)11-15(25)2-7-21(17,22)13-24)23(20,28)9-5-16(20)14-10-19(26)29-12-14/h10,13,15-18,25,27-28H,2-9,11-12H2,1H3",CC12CCC3C(CCC4(O)CC(O)CCC34C=O)C1(O)CCC2C1=CC(=O)OC1,C23H32O6,pos_1_1proton,404.2198887439999,ODJLBQGVINUMMR,Terpenoids,Steroids,Cardenolides,Adonis amurensis,243850.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis amurensis'],6,0,6.0 591,7096,-1,,,,0.0,MS1_match,ODJLBQGVINUMMR-HZXDTFASSA-N,"InChI=1S/C23H32O6/c1-20-6-3-17-18(4-8-22(27)11-15(25)2-7-21(17,22)13-24)23(20,28)9-5-16(20)14-10-19(26)29-12-14/h10,13,15-18,25,27-28H,2-9,11-12H2,1H3/t15-,16+,17-,18+,20+,21-,22-,23-/m0/s1",C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C23H32O6,pos_1_1proton,404.2198887439999,ODJLBQGVINUMMR,Terpenoids,Steroids,Cardenolides,Adonis tianschanica,6130933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis tianschanica'],6,0,6.0 592,7096,-1,,,,0.0,MS1_match,ZDNMDOAXDDWWQL-BPDBNSKVSA-N,"InChI=1S/C22H28O5/c1-11-13-7-14-19(26)21-6-4-5-20(3,10-23)15(21)9-17(27-12(2)24)22(14,18(11)25)16(21)8-13/h10,13-18,25H,1,4-9H2,2-3H3/t13-,14+,15+,16-,17+,18-,20-,21-,22+/m0/s1",C=C1[C@H]2C[C@@H]3C(=O)[C@@]45CCC[C@@](C)(C=O)[C@H]4C[C@@H](OC(C)=O)[C@]3([C@H]1O)[C@H]5C2,C22H28O5,pos_1_1proton1methanol,372.193673996,ZDNMDOAXDDWWQL,Terpenoids,Diterpenoids,Atisane diterpenoids,Delphinium campylocentrum,6131604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium campylocentrum'],6,0,6.0 593,7096,-1,,,,0.0,MS1_match,VRYQOPPFQGKTNS-UHFFFAOYSA-N,"InChI=1S/C41H70O13/c1-20(9-12-28(38(4,5)50)54-36-34(49)32(47)31(46)25(18-42)52-36)29-23(43)17-41(8)22-10-11-26-37(2,3)27(53-35-33(48)30(45)24(44)19-51-35)14-15-39(26,6)21(22)13-16-40(29,41)7/h13,20,22-36,42-50H,9-12,14-19H2,1-8H3",CC(CCC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)O)C1C(O)CC2(C)C3CCC4C(C)(CCC(OC5OCC(O)C(O)C5O)C4(C)C)C3=CCC12C,C41H70O13,pos_2_1proton1potassium,770.4816423,VRYQOPPFQGKTNS,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 594,7096,-1,,,,0.0,MS1_match,VRYQOPPFQGKTNS-UHFFFAOYSA-N,"InChI=1S/C41H70O13/c1-20(9-12-28(38(4,5)50)54-36-34(49)32(47)31(46)25(18-42)52-36)29-23(43)17-41(8)22-10-11-26-37(2,3)27(53-35-33(48)30(45)24(44)19-51-35)14-15-39(26,6)21(22)13-16-40(29,41)7/h13,20,22-36,42-50H,9-12,14-19H2,1-8H3",CC(CCC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)O)C1C(O)CC2(C)C3CCC4C(C)(CCC(OC5OCC(O)C(O)C5O)C4(C)C)C3=CCC12C,C41H70O13,pos_2_1proton1potassium,770.4816423,VRYQOPPFQGKTNS,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 595,7096,-1,,,,0.0,MS1_match,ZBALYAJAWGGUCX-RLNVAPDASA-N,"InChI=1S/C36H51N3O10/c1-6-39-17-33(18-49-31(42)19-9-7-8-10-22(19)38-26(41)12-11-25(37)40)14-13-24(46-3)35-21-15-20-23(45-2)16-34(43,27(21)28(20)47-4)36(44,32(35)39)30(48-5)29(33)35/h7-10,20-21,23-24,27-30,32,43-44H,6,11-18H2,1-5H3,(H2,37,40)(H,38,41)/t20-,21-,23+,24+,27-,28+,29-,30+,32+,33+,34-,35+,36+/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)CCC(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H51N3O10,pos_2_2proton3acetonitrile,685.357444832,ZBALYAJAWGGUCX,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium cashmerianum,884026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cashmerianum'],6,0,6.0 596,7096,-1,,,,0.0,MS1_match,XRSXVXWWMSONJI-AFECXZAASA-N,"InChI=1S/C36H51N3O10/c1-6-39-16-33(17-49-31(43)19-9-7-8-10-22(19)38-25(40)13-18(2)30(37)42)12-11-24(47-4)35-21-14-20-23(46-3)15-34(44,26(21)27(20)41)36(45,32(35)39)29(48-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,41,44-45H,6,11-17H2,1-5H3,(H2,37,42)(H,38,40)/t18-,20-,21-,23+,24+,26-,27+,28-,29+,32-,33+,34-,35-,36+/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H]13)[C@@H](OC)[C@H]24,C36H51N3O10,pos_2_2proton3acetonitrile,685.357444832,XRSXVXWWMSONJI,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium trifoliolatum,6131827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium trifoliolatum'],6,0,6.0 597,7091,9,Terpenoids,Fatty acyls,Fatty aldehydes,0.21287864,ISDB,,,,,,,SEBPXHSZHLFWRL,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8515145778656006 598,7090,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.67126364,ISDB,SDJMNNDDHQWWJH-UXCAXZQLSA-N,"InChI=1S/C18H26O3/c1-16-6-5-14(20)8-12(16)4-7-17-9-13(2-3-15(16)17)18(21,10-17)11-19/h5-6,12-13,15,19,21H,2-4,7-11H2,1H3/t12-,13-,15+,16-,17+,18+/m1/s1",C[C@@]12C=CC(=O)C[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(CO)C3,C18H26O3,,290.188194692,SDJMNNDDHQWWJH,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Diplospora dubia,729058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora dubia'],4,3,8.185054540634155 599,7088,-1,,,,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MNa,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 600,7088,-1,,,,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MNa,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,0,6.0 601,7088,-1,,,,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MNa,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,0,6.0 602,7088,-1,,,,0.0,MS1_match,JSUJHPSAVAWXEN-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MNa,462.116211524,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,0,6.0 603,7088,-1,,,,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MNa,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia olgae,6061317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olgae'],6,0,6.0 604,7088,-1,,,,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MNa,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Scabiosa atropurpurea,900954.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa atropurpurea'],6,0,6.0 605,7088,-1,,,,0.0,MS1_match,JSUJHPSAVAWXEN-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MNa,462.116211524,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,0,6.0 606,7088,-1,,,,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MNa,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia olgae,6061317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olgae'],6,0,6.0 607,7088,-1,,,,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MNa,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Scabiosa atropurpurea,900954.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa atropurpurea'],6,0,6.0 608,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MNa,462.116211524,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria leucantha,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,0,6.0 609,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria uralensis,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,0,6.0 610,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus papposus,450630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus papposus'],6,0,6.0 611,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus plumosus,5746454.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus plumosus'],6,0,6.0 612,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 613,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 614,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MNa,462.116211524,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria leucantha,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,0,6.0 615,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria uralensis,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,0,6.0 616,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus papposus,450630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus papposus'],6,0,6.0 617,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus plumosus,5746454.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus plumosus'],6,0,6.0 618,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 619,7088,-1,,,,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MNa,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 620,7088,-1,,,,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MNa,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 621,7088,-1,,,,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MNa,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 622,7088,-1,,,,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MNa,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 623,7088,-1,,,,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MNa,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,0,6.0 624,7088,-1,,,,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MNa,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,0,6.0 625,7086,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.4150284,ISDB,WKQNRCYKYCKESD-UHFFFAOYSA-N,"InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)([O-])OCC[N+](C)(C)C,C26H48NO7P,,517.316839506,WKQNRCYKYCKESD,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,7.160113573074341 626,7086,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.4150284,ISDB,WKQNRCYKYCKESD-YVHLTTHBSA-N,"InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3/b7-6-,10-9-,13-12-/t25-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H48NO7P,,517.316839506,WKQNRCYKYCKESD,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,7.160113573074341 627,7084,-1,,,,0.0,MS1_match,SXGDMINSYARVTP-ZTUHZDJASA-N,"InChI=1S/C17H28O3/c1-10-8-14(19-11(2)18)15-13(10)9-12-6-7-17(15,5)20-16(12,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12-,13-,14-,15+,17+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@H]2C[C@H]3CC[C@](C)(OC3(C)C)[C@@H]21,C17H28O3,pos_2MHNH3,280.203844756,SXGDMINSYARVTP,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 628,7084,-1,,,,0.0,MS1_match,SXGDMINSYARVTP-LPYKJYNFSA-N,"InChI=1S/C17H28O3/c1-10-8-14(19-11(2)18)15-13(10)9-12-6-7-17(15,5)20-16(12,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12+,13-,14-,15+,17-/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@H]2C[C@@H]3CC[C@@](C)(OC3(C)C)[C@@H]21,C17H28O3,pos_2MHNH3,280.203844756,SXGDMINSYARVTP,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 629,7084,-1,,,,0.0,MS1_match,CGBOQYJQRLRGIE-QFCZPAJMSA-N,"InChI=1S/C17H28O3/c1-10-6-7-13-12(10)8-14-15(19-11(2)18)9-17(13,5)20-16(14,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12-,13-,14+,15+,17+/m1/s1",CC(=O)O[C@H]1C[C@]2(C)OC(C)(C)[C@H]1C[C@@H]1[C@H](C)CC[C@H]12,C17H28O3,pos_2MHNH3,280.203844756,CGBOQYJQRLRGIE,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 630,7084,-1,,,,0.0,MS1_match,CGBOQYJQRLRGIE-QFCZPAJMSA-N,"InChI=1S/C17H28O3/c1-10-6-7-13-12(10)8-14-15(19-11(2)18)9-17(13,5)20-16(14,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12-,13-,14+,15+,17+/m1/s1",CC(=O)O[C@H]1C[C@]2(C)OC(C)(C)[C@H]1C[C@@H]1[C@H](C)CC[C@H]12,C17H28O3,pos_2MHNH3,280.203844756,CGBOQYJQRLRGIE,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 631,7084,-1,,,,0.0,MS1_match,GHMRGLKPQJPFCD-DJIMGWMZSA-N,"InChI=1S/C17H28O3/c1-12(2)7-6-8-14(4)17(19)10-9-13(3)11-16(17)20-15(5)18/h7,11,14,16,19H,6,8-10H2,1-5H3/t14-,16-,17-/m1/s1",CC(=O)O[C@@H]1C=C(C)CC[C@@]1(O)[C@H](C)CCC=C(C)C,C17H28O3,pos_2MHNH3,280.203844756,GHMRGLKPQJPFCD,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 632,7084,-1,,,,0.0,MS1_match,GHMRGLKPQJPFCD-DJIMGWMZSA-N,"InChI=1S/C17H28O3/c1-12(2)7-6-8-14(4)17(19)10-9-13(3)11-16(17)20-15(5)18/h7,11,14,16,19H,6,8-10H2,1-5H3/t14-,16-,17-/m1/s1",CC(=O)O[C@@H]1C=C(C)CC[C@@]1(O)[C@H](C)CCC=C(C)C,C17H28O3,pos_2MHNH3,280.203844756,GHMRGLKPQJPFCD,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 633,7084,-1,,,,0.0,MS1_match,DWBIYQVLFODAMM-JWQALPOXSA-N,"InChI=1S/C17H28O3/c1-11-5-6-15-14(11)9-13-7-8-16(15,3)20-17(13,4)10-19-12(2)18/h11,13-15H,5-10H2,1-4H3/t11-,13-,14-,15-,16+,17-/m1/s1",CC(=O)OC[C@@]1(C)O[C@@]2(C)CC[C@@H]1C[C@@H]1[C@H](C)CC[C@H]12,C17H28O3,pos_2MHNH3,280.203844756,DWBIYQVLFODAMM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 634,7084,-1,,,,0.0,MS1_match,RAPAFGOPSFDECW-CKQPZERJSA-N,"InChI=1S/C17H28O3/c1-10-6-7-17(19)15(3,4)13-8-12(10)16(17,5)9-14(13)20-11(2)18/h10,12-14,19H,6-9H2,1-5H3/t10-,12-,13-,14-,16-,17+/m0/s1",CC(=O)O[C@H]1C[C@@]2(C)[C@H]3C[C@@H]1C(C)(C)[C@]2(O)CC[C@@H]3C,C17H28O3,pos_2MHNH3,280.203844756,RAPAFGOPSFDECW,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 635,7084,-1,,,,0.0,MS1_match,RAPAFGOPSFDECW-UCDKGCPTSA-N,"InChI=1S/C17H28O3/c1-10-6-7-17(19)15(3,4)13-8-12(10)16(17,5)9-14(13)20-11(2)18/h10,12-14,19H,6-9H2,1-5H3/t10-,12-,13-,14+,16-,17+/m0/s1",CC(=O)O[C@@H]1C[C@@]2(C)[C@H]3C[C@@H]1C(C)(C)[C@]2(O)CC[C@@H]3C,C17H28O3,pos_2MHNH3,280.203844756,RAPAFGOPSFDECW,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 636,7084,-1,,,,0.0,MS1_match,RAPAFGOPSFDECW-UCDKGCPTSA-N,"InChI=1S/C17H28O3/c1-10-6-7-17(19)15(3,4)13-8-12(10)16(17,5)9-14(13)20-11(2)18/h10,12-14,19H,6-9H2,1-5H3/t10-,12-,13-,14+,16-,17+/m0/s1",CC(=O)O[C@@H]1C[C@@]2(C)[C@H]3C[C@@H]1C(C)(C)[C@]2(O)CC[C@@H]3C,C17H28O3,pos_2MHNH3,280.203844756,RAPAFGOPSFDECW,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 637,7084,-1,,,,0.0,MS1_match,ODJYOWOONQGNHL-ANCINPQNSA-N,"InChI=1S/C17H28O3/c1-10-13-8-12-6-7-17(5,20-16(12,3)4)14(13)9-15(10)19-11(2)18/h10,12-15H,6-9H2,1-5H3/t10-,12-,13+,14+,15-,17+/m0/s1",CC(=O)O[C@H]1C[C@@H]2[C@H](C[C@@H]3CC[C@@]2(C)OC3(C)C)[C@@H]1C,C17H28O3,pos_2MHNH3,280.203844756,ODJYOWOONQGNHL,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 638,7082,-1,,,,0.0,MS1_match,RRAFCDWBNXTKKO-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3",C=CCc1ccc(O)c(OC)c1,C10H12O2,pos_2MNa,164.083729624,RRAFCDWBNXTKKO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 639,7082,-1,,,,0.0,MS1_match,LREHGXOCZVBABG-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-5-8-6-4-7-9(12-2)10(8)11/h3-4,6-7,11H,1,5H2,2H3",C=CCc1cccc(OC)c1O,C10H12O2,pos_2MNa,164.083729624,LREHGXOCZVBABG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 640,7082,-1,,,,0.0,MS1_match,PANKHBYNKQNAHN-MQQNZMFNSA-N,"InChI=1S/C20H24O4/c1-15(11-7-13-17(3)19(21)22)9-5-6-10-16(2)12-8-14-18(4)20(23)24/h5-14H,1-4H3,(H,21,22)(H,23,24)/b6-5+,11-7+,12-8+,15-9+,16-10+,17-13+,18-14+",CC(/C=C/C=C(\C)C(=O)O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O,C20H24O4,pos_1_sodium,328.16745924799994,PANKHBYNKQNAHN,Terpenoids,Apocarotenoids,Miscellaneous apocarotenoids,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,0,7.0 641,7082,-1,,,,0.0,MS1_match,PANKHBYNKQNAHN-MQQNZMFNSA-N,"InChI=1S/C20H24O4/c1-15(11-7-13-17(3)19(21)22)9-5-6-10-16(2)12-8-14-18(4)20(23)24/h5-14H,1-4H3,(H,21,22)(H,23,24)/b6-5+,11-7+,12-8+,15-9+,16-10+,17-13+,18-14+",CC(/C=C/C=C(\C)C(=O)O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)O,C20H24O4,pos_1_sodium,328.16745924799994,PANKHBYNKQNAHN,Terpenoids,Apocarotenoids,Miscellaneous apocarotenoids,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,0,7.0 642,7077,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.67784745,ISDB,KJSAXQYTHNRIBJ-YRGRVCCFSA-N,"InChI=1S/C14H20O2/c1-10(13(15)16)11-6-8-14(2)7-4-3-5-12(14)9-11/h3,5,11-12H,1,4,6-9H2,2H3,(H,15,16)/t11-,12-,14-/m1/s1",C=C(C(=O)O)[C@@H]1CC[C@@]2(C)CCC=C[C@@H]2C1,C14H20O2,,220.14632988,KJSAXQYTHNRIBJ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Dittrichia graveolens,3899100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Dittrichia'],['Dittrichia graveolens'],4,2,7.711389780044556 643,7074,-1,,,,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1ammonium,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 644,7073,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton1ammonium,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 645,7073,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton1ammonium,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 646,7073,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton1ammonium,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 647,7070,-1,,,,0.0,MS1_match,OVLDHOAUOKJCIX-SFHVURJKSA-N,"InChI=1S/C18H20N2O3/c1-18(23)10-14-16(15(22)11-18)17(12-4-6-13(21)7-5-12)20-9-3-2-8-19(14)20/h4-7,23H,2-3,8-11H2,1H3/t18-/m0/s1",C[C@@]1(O)CC(=O)C2=C(C1)N1CCCCN1C2=C1C=CC(=O)C=C1,C18H20N2O3,pos_1_1proton1ethylamine,312.1473925,OVLDHOAUOKJCIX,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 648,7066,-1,,,,0.5190903,ISDB,WMAMGZISNJIRAE-UHFFFAOYSA-N,"InChI=1S/C18H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7H,2-5,8,13-17H2,1H3,(H,19,20)",CCCCCC=CCC#CC#CCCCCCC(=O)O,C18H26O2,,274.193280072,WMAMGZISNJIRAE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Heisteria acuminata,347246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Santalales'],['Erythropalaceae'],['Unknown'],['Heisteria'],['Heisteria acuminata'],4,0,6.076361179351807 649,7065,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.6661478,ISDB,DWGKMGKTDBRQJE-AFHBHXEDSA-N,"InChI=1S/C21H22O7/c1-23-16-5-11(3-4-15(16)22)19-13-8-26-20(14(13)9-25-19)12-6-17(24-2)21-18(7-12)27-10-28-21/h3-7,13-14,19-20,22H,8-10H2,1-2H3/t13-,14-,19+,20+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2cc(OC)c3c(c2)OCO3)ccc1O,C21H22O7,,386.136553044,DWGKMGKTDBRQJE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Nectandra turbacensis,1081324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Nectandra'],['Nectandra turbacensis'],4,3,8.164591312408447 650,7063,970,Fatty acids,Octadecanoids,Other Octadecanoids,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_2MHCH3CN,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 651,7063,970,Fatty acids,Octadecanoids,Other Octadecanoids,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_2MHCH3CN,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 652,7061,625,Terpenoids,Diterpenoids,Pregnane steroids,0.545009,ISDB,PQNOCJMPOHKMIT-HMCHPOHQSA-N,"InChI=1S/C22H36O4/c1-5-12-16(23)11-22(4)14-6-7-15-18(25)19(26)17(24)10-20(15,2)13(14)8-9-21(12,22)3/h12-15,17-19,24-26H,5-11H2,1-4H3/t12-,13-,14+,15+,17-,18+,19-,20+,21+,22-/m0/s1",CC[C@H]1C(=O)C[C@@]2(C)[C@@H]3CC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C22H36O4,,364.261359632,PQNOCJMPOHKMIT,Terpenoids,Steroids,Pregnane steroids,Epicharis densiflora,5747793.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Dysoxylum'],['Dysoxylum densiflorum'],4,3,7.6800360679626465 653,7061,625,Terpenoids,Diterpenoids,Pregnane steroids,0.545009,ISDB,PQNOCJMPOHKMIT-HMCHPOHQSA-N,"InChI=1S/C22H36O4/c1-5-12-16(23)11-22(4)14-6-7-15-18(25)19(26)17(24)10-20(15,2)13(14)8-9-21(12,22)3/h12-15,17-19,24-26H,5-11H2,1-4H3/t12-,13-,14+,15+,17-,18+,19-,20+,21+,22-/m0/s1",CC[C@H]1C(=O)C[C@@]2(C)[C@@H]3CC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C22H36O4,,364.261359632,PQNOCJMPOHKMIT,Terpenoids,Steroids,Pregnane steroids,Dysoxylum densiflorum,5747793.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Dysoxylum'],['Dysoxylum densiflorum'],4,3,7.6800360679626465 654,7057,-1,,,,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_2MHCH3CN,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 655,7057,-1,,,,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_2MHCH3CN,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 656,7055,887,Terpenoids,Sesquiterpenoids,Acyclic monoterpenoids,0.26054645,ISDB,GVKOSTDVQZCJJT-ZHSDAYTOSA-N,"InChI=1S/C14H24O3/c1-13(2)10-6-4-5-9(12(16)17)14(10,3)8-7-11(13)15/h9-11,15H,4-8H2,1-3H3,(H,16,17)/t9-,10-,11-,14-/m1/s1",CC1(C)[C@H](O)CC[C@]2(C)[C@@H](C(=O)O)CCC[C@H]12,C14H24O3,,240.172544628,GVKOSTDVQZCJJT,Terpenoids,Sesquiterpenoids,,Verbascum thapsus,35629.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Verbascum'],['Verbascum thapsus'],4,2,6.0421857833862305 657,7052,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,ZNCHZFFUPFZQEP-IBGZPJMESA-N,"InChI=1S/C19H25NO/c1-11(2)17-14-7-13-12(3)8-18(4,5)20-15(13)9-19(14,6)10-16(17)21/h7-8,11H,9-10H2,1-6H3/t19-/m0/s1",CC1=CC(C)(C)N=C2C[C@@]3(C)CC(=O)C(C(C)C)=C3C=C12,C19H25NO,pos_2MHNH3,283.19361442,ZNCHZFFUPFZQEP,Terpenoids,Diterpenoids,,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,1,6.5 658,7052,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,ZNCHZFFUPFZQEP-IBGZPJMESA-N,"InChI=1S/C19H25NO/c1-11(2)17-14-7-13-12(3)8-18(4,5)20-15(13)9-19(14,6)10-16(17)21/h7-8,11H,9-10H2,1-6H3/t19-/m0/s1",CC1=CC(C)(C)N=C2C[C@@]3(C)CC(=O)C(C(C)C)=C3C=C12,C19H25NO,pos_2MHNH3,283.19361442,ZNCHZFFUPFZQEP,Terpenoids,Diterpenoids,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,1,6.5 659,7052,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,ZLLJDNGQDGFFLK-IBGZPJMESA-N,"InChI=1S/C19H25NO/c1-11(2)13-7-14-17-12(3)8-18(4,5)20-15(17)9-19(14,6)10-16(13)21/h7-8,11H,9-10H2,1-6H3/t19-/m0/s1",CC1=CC(C)(C)N=C2C[C@@]3(C)CC(=O)C(C(C)C)=CC3=C12,C19H25NO,pos_2MHNH3,283.19361442,ZLLJDNGQDGFFLK,Terpenoids,Diterpenoids,,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,1,6.5 660,7052,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,ZLLJDNGQDGFFLK-IBGZPJMESA-N,"InChI=1S/C19H25NO/c1-11(2)13-7-14-17-12(3)8-18(4,5)20-15(17)9-19(14,6)10-16(13)21/h7-8,11H,9-10H2,1-6H3/t19-/m0/s1",CC1=CC(C)(C)N=C2C[C@@]3(C)CC(=O)C(C(C)C)=CC3=C12,C19H25NO,pos_2MHNH3,283.19361442,ZLLJDNGQDGFFLK,Terpenoids,Diterpenoids,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,1,6.5 661,7050,-1,,,,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton2acetonitrile,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 662,7050,-1,,,,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton2acetonitrile,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 663,7049,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_2MH,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 664,7047,-1,,,,0.2802708,ISDB,XLLPFFSFQQPASS-KZIVNFMESA-N,"InChI=1S/C19H30O4/c1-3-4-10-15-19(22)16(13-14-17(19)20)11-8-6-5-7-9-12-18(21)23-2/h4,10,13,22H,3,5-9,11-12,14-15H2,1-2H3/b10-4-/t19-/m1/s1",CC/C=C\C[C@]1(O)C(=O)CC=C1CCCCCCCC(=O)OC,C19H30O4,,322.21440943999994,XLLPFFSFQQPASS,,,,Chromolaena morii,5920820.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Chromolaena'],['Chromolaena morii'],4,0,5.1210832595825195 665,7045,451,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.5292721,ISDB,NNOHQDGLBSBWNG-YVGXBJCXSA-N,"InChI=1S/C30H32O7/c1-14(2)7-6-10-30(5)18-11-17-27(35)25-22(13-19(31)16(26(25)34)9-8-15(3)4)36-28(17)24-20(32)12-21(33)29(37-30)23(18)24/h7-8,12-13,18,31-34H,6,9-11H2,1-5H3/t18-,30+/m0/s1",CC(C)=CCC[C@@]1(C)Oc2c(O)cc(O)c3c2[C@@H]1Cc1c-3oc2cc(O)c(CC=C(C)C)c(O)c2c1=O,C30H32O7,,504.2148033639999,NNOHQDGLBSBWNG,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Artocarpus rigidus,563906.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Artocarpus'],['Artocarpus rigidus'],4,3,7.617088317871094 666,7044,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.5092894,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea prunifolia,7606947.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea prunifolia'],4,3,7.5371575355529785 667,7044,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.5092894,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea jamaicensis,431707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea jamaicensis'],4,3,7.5371575355529785 668,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MH,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 669,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MH,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 670,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MH,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 671,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MH,462.116211524,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,2,7.0 672,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MH,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia olgae,6061317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olgae'],6,2,7.0 673,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MH,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Scabiosa atropurpurea,900954.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa atropurpurea'],6,2,7.0 674,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MH,462.116211524,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,2,7.0 675,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MH,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia olgae,6061317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olgae'],6,2,7.0 676,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_2MH,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Scabiosa atropurpurea,900954.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa atropurpurea'],6,2,7.0 677,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MH,462.116211524,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria leucantha,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 678,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria uralensis,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 679,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus papposus,450630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus papposus'],6,2,7.0 680,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus plumosus,5746454.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus plumosus'],6,2,7.0 681,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 682,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 683,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_2MH,462.116211524,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria leucantha,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 684,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria uralensis,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 685,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus papposus,450630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus papposus'],6,2,7.0 686,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus plumosus,5746454.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus plumosus'],6,2,7.0 687,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 688,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_2MH,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 689,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MH,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 690,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MH,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 691,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_2MH,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 692,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MH,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 693,7041,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_2MH,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 694,7040,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.2848477,ISDB,MPMUYJRHIOEINH-MRXNPFEDSA-N,"InChI=1S/C20H32O4/c1-3-5-6-7-8-9-10-11-12-14-17(21)19-18(22)15-16(13-4-2)24-20(19)23/h3,16,22H,1,4-15H2,2H3/t16-/m1/s1",C=CCCCCCCCCCC(=O)C1=C(O)C[C@@H](CCC)OC1=O,C20H32O4,,336.230059504,MPMUYJRHIOEINH,Polyketides,Cyclic polyketides,2-pyrone derivatives,Podophyllum peltatum,928422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Podophyllum'],['Podophyllum peltatum'],5,1,6.639390826225281 695,7039,1857,Shikimates and Phenylpropanoids,Lignans,,0.31769264,ISDB,XVECPILXJDKZJX-OKKVRJOVSA-N,"InChI=1S/C28H38O12/c1-34-18-9-6-15(12-21(18)36-3)17(30)8-11-20(39-28-26(33)25(32)24(31)23(14-29)40-28)27(38-5)16-7-10-19(35-2)22(13-16)37-4/h6-7,9-10,12-13,20,23-29,31-33H,8,11,14H2,1-5H3/t20-,23-,24-,25+,26-,27+,28-/m1/s1",COc1ccc(C(=O)CC[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](OC)c2ccc(OC)c(OC)c2)cc1OC,C28H38O12,,566.236326656,XVECPILXJDKZJX,Shikimates and Phenylpropanoids,Lignans,,Curculigo capitulata,807749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hypoxidaceae'],['Unknown'],['Molineria'],['Molineria capitulata'],4,2,6.27077054977417 696,7039,1857,Shikimates and Phenylpropanoids,Lignans,,0.31769264,ISDB,XVECPILXJDKZJX-OKKVRJOVSA-N,"InChI=1S/C28H38O12/c1-34-18-9-6-15(12-21(18)36-3)17(30)8-11-20(39-28-26(33)25(32)24(31)23(14-29)40-28)27(38-5)16-7-10-19(35-2)22(13-16)37-4/h6-7,9-10,12-13,20,23-29,31-33H,8,11,14H2,1-5H3/t20-,23-,24-,25+,26-,27+,28-/m1/s1",COc1ccc(C(=O)CC[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](OC)c2ccc(OC)c(OC)c2)cc1OC,C28H38O12,,566.236326656,XVECPILXJDKZJX,Shikimates and Phenylpropanoids,Lignans,,Molineria capitulata,807749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hypoxidaceae'],['Unknown'],['Molineria'],['Molineria capitulata'],4,2,6.27077054977417 697,7038,1073,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.87899154,ISDB,PXSBFPSCQXSITH-BQULAQKPSA-N,"InChI=1S/C18H23NO5/c1-21-11-6-9-8-19-5-4-18-16(19)13(10(9)7-12(11)22-2)14(20)15(23-3)17(18)24-18/h6-7,13-17,20H,4-5,8H2,1-3H3/t13-,14+,15-,16+,17+,18-/m1/s1",COc1cc2c(cc1OC)[C@@H]1[C@H](O)[C@@H](OC)[C@@H]3O[C@@]34CCN(C2)[C@@H]14,C18H23NO5,,333.157622836,PXSBFPSCQXSITH,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Lycoris incarnata,992964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Lycoris'],['Lycoris incarnata'],4,0,7.515966176986694 698,7038,1073,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.87899154,ISDB,PXSBFPSCQXSITH-BQULAQKPSA-N,"InChI=1S/C18H23NO5/c1-21-11-6-9-8-19-5-4-18-16(19)13(10(9)7-12(11)22-2)14(20)15(23-3)17(18)24-18/h6-7,13-17,20H,4-5,8H2,1-3H3/t13-,14+,15-,16+,17+,18-/m1/s1",COc1cc2c(cc1OC)[C@@H]1[C@H](O)[C@@H](OC)[C@@H]3O[C@@]34CCN(C2)[C@@H]14,C18H23NO5,,333.157622836,PXSBFPSCQXSITH,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Galanthus elwesii,1090686.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Galanthus'],['Galanthus elwesii'],4,0,7.515966176986694 699,7036,559,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.8579796,ISDB,MGUTYWPZCZBAGE-JZDIRDTQSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h14,16,19-20,22-23,25,27,31,33,42H,6-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H78NO8P,,779.546505086,MGUTYWPZCZBAGE,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,5.931918382644653 700,7036,559,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.8579796,ISDB,MGUTYWPZCZBAGE-JZDIRDTQSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h14,16,19-20,22-23,25,27,31,33,42H,6-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H78NO8P,,779.546505086,MGUTYWPZCZBAGE,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,5.931918382644653 701,7034,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.55674994,ISDB,,,,,,,RRNBQRFYTJZBGR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.2269997596740723 702,7033,1629,Terpenoids,Sesquiterpenoids,Other Octadecanoids,0.6907837,ISDB,SDJMNNDDHQWWJH-UXCAXZQLSA-N,"InChI=1S/C18H26O3/c1-16-6-5-14(20)8-12(16)4-7-17-9-13(2-3-15(16)17)18(21,10-17)11-19/h5-6,12-13,15,19,21H,2-4,7-11H2,1H3/t12-,13-,15+,16-,17+,18+/m1/s1",C[C@@]12C=CC(=O)C[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(CO)C3,C18H26O3,,290.188194692,SDJMNNDDHQWWJH,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Diplospora dubia,729058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora dubia'],4,1,7.263134717941284 703,7028,-1,,,,0.21347076,ISDB,GADHXAAUEPUWOY-SCFLWNJASA-N,"InChI=1S/C31H48O6/c1-19(9-8-10-20(2)27(33)34)23-15-16-31(6)25-13-11-22(21(3)28(35)36)24(12-14-26(32)37-7)29(25,4)17-18-30(23,31)5/h10,19,23-25H,8-9,11-18H2,1-7H3,(H,33,34)(H,35,36)/b20-10+,22-21?/t19?,23-,24-,25?,29+,30-,31+/m1/s1",COC(=O)CC[C@@H]1C(=C(C)C(=O)O)CCC2[C@]3(C)CC[C@H](C(C)CC/C=C(\C)C(=O)O)[C@@]3(C)CC[C@]21C,C31H48O6,,516.345089256,GADHXAAUEPUWOY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Russula vinosa,1016004.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Russulales'],['Russulaceae'],['Unknown'],['Russula'],['Russula vinosa'],1,0,1.8538830280303955 704,7021,-1,,,,0.26863104,ISDB,JZGSAQYOKZSOSY-UHFFFAOYSA-N,"InChI=1S/C42H70O13/c1-20(2)10-9-11-21(3)22-12-15-41(7)29(22)23(45)16-27-40(6)14-13-28(46)39(4,5)36(40)24(17-42(27,41)8)52-38-35(33(50)31(48)26(19-44)54-38)55-37-34(51)32(49)30(47)25(18-43)53-37/h10-11,22-38,43-51H,9,12-19H2,1-8H3",CC(C)=CCC=C(C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)CC12C,C42H70O13,,782.4816423000001,JZGSAQYOKZSOSY,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,0,5.074524164199829 705,7017,955,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.0,MS1_match,HSUIVCLOAAJSRE-UHFFFAOYSA-N,"InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3",COCCOC(=O)c1ccccc1C(=O)OCCOC,C14H18O6,pos_1_1proton1acetonitrile,282.110338296,HSUIVCLOAAJSRE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 706,7015,-1,,,,0.22682622,ISDB,,,,,,,VDWVQLTYVQQUDC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9073048830032349 707,7013,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.21313082,ISDB,CHXKWWFZFWRSQU-CGFWMYSESA-N,"InChI=1S/C15H24O6/c1-14(20,6-17)10-9-8-4-3-7(5-16)15(8,2)12(18)11(10)21-13(9)19/h7-12,16-18,20H,3-6H2,1-2H3/t7-,8-,9+,10+,11+,12+,14-,15+/m0/s1",C[C@@]12[C@H](CO)CC[C@H]1[C@H]1C(=O)O[C@H]([C@@H]1[C@@](C)(O)CO)[C@H]2O,C15H24O6,,300.157288488,CHXKWWFZFWRSQU,Terpenoids,Sesquiterpenoids,Picrotoxane sesquiterpenoids,Dendrobium nobile,508208.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Malaxideae'],['Dendrobium'],['Dendrobium nobile'],4,1,5.3525232672691345 708,7007,1287,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IQPNAANSBPBGFQ-UHFFFAOYSA-N,"InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O6,pos_2MK,286.04773804,IQPNAANSBPBGFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,9.0 709,7004,-1,,,,0.0,MS1_match,BXHNPANVAVZGPS-XVQMKXSKSA-N,"InChI=1S/C34H37NO12/c1-13-18-21(40)19-26-34-24(20(35(26)6)28(42)33(19,27(13)41)25(34)22(18)44-14(2)37)32(5,12-36)29(45-15(3)38)23(30(34)46-16(4)39)47-31(43)17-10-8-7-9-11-17/h7-12,18-20,22-30,41-42H,1H2,2-6H3/t18-,19?,20+,22+,23-,24+,25?,26?,27-,28+,29-,30+,32-,33-,34+/m0/s1",C=C1[C@H]2C(=O)C3C4N(C)[C@H]5[C@@H](O)[C@@]3(C([C@@H]2OC(C)=O)[C@@]42[C@H](OC(C)=O)[C@@H](OC(=O)c3ccccc3)[C@H](OC(C)=O)[C@@](C)(C=O)[C@@H]52)[C@H]1O,C34H37NO12,pos_2_2proton3acetonitrile,651.231575624,BXHNPANVAVZGPS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 710,6998,-1,,,,0.51987875,ISDB,VHVLBZCVJBGAGR-UHFFFAOYSA-N,"InChI=1S/C9H12O/c10-9-6-2-4-7-3-1-5-8(7)9/h5,7H,1-4,6H2",O=C1CCCC2CCC=C12,C9H12O,,136.088815004,VHVLBZCVJBGAGR,,,,Nepeta nepetella,482710.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta nepetella'],4,0,6.079514980316162 711,6997,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MH,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 712,6997,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MH,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 713,6996,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 714,6996,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 715,6992,1061,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.68588775,ISDB,HKMDHBXRMZEVHY-UHFFFAOYSA-N,"InChI=1S/C16H26O8/c1-7-8-3-4-16(2,9(8)6-22-14(7)21)24-15-13(20)12(19)11(18)10(5-17)23-15/h7-13,15,17-20H,3-6H2,1-2H3",CC1C(=O)OCC2C1CCC2(C)OC1OC(CO)C(O)C(O)C1O,C16H26O8,,346.1627677919999,HKMDHBXRMZEVHY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,10.243551015853882 716,6991,462,Terpenoids,Steroids,Cholestane steroids,0.32162714,ISDB,IWNCBADONFSAAW-NFVQQQKOSA-N,"InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,18-20,22-25,27,31H,7-15,17H2,1-6H3/t19-,20-,22+,23-,24+,25+,27-,28-,29-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C29H48O2,,428.365430776,IWNCBADONFSAAW,Terpenoids,Steroids,Stigmastane steroids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,2,8.286508560180664 717,6989,563,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MWLKXILGJPSPKZ-LWSBBEHMSA-N,"InChI=1S/C34H46O19/c1-5-15-17(18(29(44)46-3)12-48-31(15)52-33-27(42)25(40)23(38)20(10-36)50-33)8-7-14(9-35)22-16(6-2)32(49-13-19(22)30(45)47-4)53-34-28(43)26(41)24(39)21(11-37)51-34/h5-7,9,12-13,15-17,20-28,31-34,36-43H,1-2,8,10-11H2,3-4H3/b14-7+/t15-,16-,17+,20-,21-,22+,23-,24-,25+,26+,27-,28-,31+,32+,33+,34+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C/C=C(\C=O)[C@@H]1C(C(=O)OC)=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1C=C,C34H46O19,pos_1_1proton1acetonitrile,758.263329252,MWLKXILGJPSPKZ,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 718,6989,563,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MWLKXILGJPSPKZ-UHFFFAOYSA-N,"InChI=1S/C34H46O19/c1-5-15-17(18(29(44)46-3)12-48-31(15)52-33-27(42)25(40)23(38)20(10-36)50-33)8-7-14(9-35)22-16(6-2)32(49-13-19(22)30(45)47-4)53-34-28(43)26(41)24(39)21(11-37)51-34/h5-7,9,12-13,15-17,20-28,31-34,36-43H,1-2,8,10-11H2,3-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=C(C=O)C1C(C(=O)OC)=COC(OC2OC(CO)C(O)C(O)C2O)C1C=C,C34H46O19,pos_1_1proton1acetonitrile,758.263329252,MWLKXILGJPSPKZ,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 719,6987,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.8140927,ISDB,,,,,,,BEKYZOSRHNMGCR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.256370782852173 720,6984,1230,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,CWHCBJYWFQQIOT-GZKNRDGBSA-N,"InChI=1S/C28H32O17/c1-40-26-20(35)17-13(32)5-10(6-14(17)43-25(26)9-2-3-11(30)12(31)4-9)42-28-24(39)22(37)19(34)16(45-28)8-41-27-23(38)21(36)18(33)15(7-29)44-27/h2-6,15-16,18-19,21-24,27-34,36-39H,7-8H2,1H3/t15-,16-,18-,19-,21+,22+,23-,24-,27-,28-/m1/s1",COc1c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c2c1=O,C28H32O17,pos_1_1proton,640.163949564,CWHCBJYWFQQIOT,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],8,3,9.5 721,6983,394,Fatty acids,Fatty amides,Wax monoesters,0.27715066,ISDB,ZPPOXVDQLJMPLN-JHHNBRACSA-N,"InChI=1S/C20H37NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(22)16-19(23)21-17(2)20(24)25-3/h9-10,17-18,22H,4-8,11-16H2,1-3H3,(H,21,23)/b10-9-/t17-,18?/m0/s1",CCCCCC/C=C\CCCCCC(O)CC(=O)N[C@@H](C)C(=O)OC,C20H37NO4,,355.272258664,ZPPOXVDQLJMPLN,Fatty acids,Fatty amides,N-acyl amines,Roseovarius tolerans,191091.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Alphaproteobacteria'],['Rhodobacterales'],['Rhodobacteraceae'],['Unknown'],['Roseovarius'],['Roseovarius tolerans'],0,2,2.1086026430130005 722,6979,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.7803218,ISDB,NJDITOSUCXZLIG-AUWJEWJLSA-N,"InChI=1S/C17H24O3/c1-13(2)5-4-6-14(12-18)7-8-15-11-16(19)9-10-17(15)20-3/h5,7,9-11,18-19H,4,6,8,12H2,1-3H3/b14-7-",COc1ccc(O)cc1C/C=C(\CO)CCC=C(C)C,C17H24O3,,276.172544628,NJDITOSUCXZLIG,Terpenoids,Meroterpenoids,Merosesquiterpenoids,Heliotropium glutinosum,172317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Heliotropiaceae'],['Unknown'],['Heliotropium'],['Heliotropium glutinosum'],4,1,7.621287107467651 723,6975,935,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.24748085,ISDB,TXXCMIRGHOXDGD-PZSZWBGDSA-N,"InChI=1S/C17H28O6/c1-10-6-7-11-15(22-11)9-17(21-5)16(19,8-13(10,15)2)14(3,18)12(20-4)23-17/h10-12,18-19H,6-9H2,1-5H3/t10-,11+,12-,13+,14+,15+,16+,17-/m1/s1",CO[C@@H]1O[C@]2(OC)C[C@]34O[C@H]3CC[C@@H](C)[C@]4(C)C[C@]2(O)[C@@]1(C)O,C17H28O6,,328.188588616,TXXCMIRGHOXDGD,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Senecio nemorensis,742737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Senecio'],['Senecio nemorensis'],4,3,6.489923417568207 724,6972,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,YDYHOAALGZGNKR-IVTISIJFSA-N,"InChI=1S/C28H40O10/c1-8-18(6)11-25(32)37-22-12-21-20(13-34-19(7)29)14-35-27(38-24(31)10-17(4)5)26(21)28(22,33)15-36-23(30)9-16(2)3/h10,12,14,16,18,22,26-27,33H,8-9,11,13,15H2,1-7H3/t18-,22-,26+,27-,28+/m0/s1",CC[C@H](C)CC(=O)O[C@H]1C=C2C(COC(C)=O)=CO[C@@H](OC(=O)C=C(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)C,C28H40O10,pos_1_1potassium,536.26214748,YDYHOAALGZGNKR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 725,6969,1651,Terpenoids,Steroids,Ergostane steroids,0.20192729,ISDB,LLYWQHCOIOSCFV-BELJYMGFSA-N,"InChI=1S/C39H68O6/c1-24(2)25(3)12-13-26(4)30-16-17-31-29-15-14-27-22-28(18-20-33(27,5)32(29)19-21-34(30,31)6)44-38(10)35(7,23-40)45-39(11,43)37(9,42)36(38,8)41/h14,24-26,28-32,40-43H,12-13,15-23H2,1-11H3/t25-,26-,28+,29-,30-,31-,32-,33-,34-,35+,36-,37+,38+,39+/m1/s1",CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@@H]2[C@H]3CC=C4C[C@@H](O[C@]5(C)[C@](C)(O)[C@](C)(O)[C@@](C)(O)O[C@@]5(C)CO)CC[C@@]4(C)[C@@H]3CC[C@@]21C,C39H68O6,,632.501589896,LLYWQHCOIOSCFV,Terpenoids,Steroids,Ergostane steroids,Prunus mahaleb,1012886.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus mahaleb'],4,3,6.307709157466888 726,6966,-1,,,,0.0,MS1_match,RQLWDYSEFWBFBP-FAKSOFLMSA-N,"InChI=1S/C26H28O15/c27-6-16-20(35)21(36)25(41-26-22(37)19(34)14(33)7-38-26)24(40-16)18-12(31)4-11(30)17-13(32)5-15(39-23(17)18)8-1-2-9(28)10(29)3-8/h1-5,14,16,19-22,24-31,33-37H,6-7H2/t14-,16-,19-,20-,21+,22-,24+,25-,26-/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)c(O)cc(O)c12,C26H28O15,pos_1_sodium,580.1428201959998,RQLWDYSEFWBFBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,0,6.0 727,6966,-1,,,,0.0,MS1_match,RQLWDYSEFWBFBP-VXSQXEALSA-N,"InChI=1S/C26H28O15/c27-6-16-20(35)21(36)25(41-26-22(37)19(34)14(33)7-38-26)24(40-16)18-12(31)4-11(30)17-13(32)5-15(39-23(17)18)8-1-2-9(28)10(29)3-8/h1-5,14,16,19-22,24-31,33-37H,6-7H2/t14-,16+,19-,20+,21-,22+,24-,25+,26-/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O[C@H]3OC[C@@H](O)[C@@H](O)[C@@H]3O)c(O)cc(O)c12,C26H28O15,pos_1_sodium,580.142820196,RQLWDYSEFWBFBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 728,6966,-1,,,,0.0,MS1_match,RQLWDYSEFWBFBP-FAKSOFLMSA-N,"InChI=1S/C26H28O15/c27-6-16-20(35)21(36)25(41-26-22(37)19(34)14(33)7-38-26)24(40-16)18-12(31)4-11(30)17-13(32)5-15(39-23(17)18)8-1-2-9(28)10(29)3-8/h1-5,14,16,19-22,24-31,33-37H,6-7H2/t14-,16-,19-,20-,21+,22-,24+,25-,26-/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)c(O)cc(O)c12,C26H28O15,pos_1_sodium,580.1428201959998,RQLWDYSEFWBFBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,0,6.0 729,6966,-1,,,,0.0,MS1_match,RQLWDYSEFWBFBP-VXSQXEALSA-N,"InChI=1S/C26H28O15/c27-6-16-20(35)21(36)25(41-26-22(37)19(34)14(33)7-38-26)24(40-16)18-12(31)4-11(30)17-13(32)5-15(39-23(17)18)8-1-2-9(28)10(29)3-8/h1-5,14,16,19-22,24-31,33-37H,6-7H2/t14-,16+,19-,20+,21-,22+,24-,25+,26-/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O[C@H]3OC[C@@H](O)[C@@H](O)[C@@H]3O)c(O)cc(O)c12,C26H28O15,pos_1_sodium,580.142820196,RQLWDYSEFWBFBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 730,6966,-1,,,,0.0,MS1_match,WYYFCTVKFALPQV-MCIQUCDDSA-N,"InChI=1S/C26H28O15/c27-5-13-18(33)21(36)23(38)26(41-13)16-20(35)15(25-22(37)17(32)11(31)6-39-25)19(34)14-10(30)4-12(40-24(14)16)7-1-2-8(28)9(29)3-7/h1-4,11,13,17-18,21-23,25-29,31-38H,5-6H2/t11-,13-,17+,18-,21+,22-,23-,25+,26+/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c([C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C26H28O15,pos_1_sodium,580.142820196,WYYFCTVKFALPQV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 731,6966,-1,,,,0.0,MS1_match,JBXDRWCPGRKZIO-XTXTUNRQSA-N,"InChI=1S/C26H28O15/c27-7-15-18(32)20(34)22(36)26(40-15)41-24-19(33)16-12(29)5-11(38-25-21(35)17(31)13(30)8-37-25)6-14(16)39-23(24)9-1-3-10(28)4-2-9/h1-6,13,15,17-18,20-22,25-32,34-36H,7-8H2/t13-,15+,17-,18-,20-,21+,22+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)cc(O)c12,C26H28O15,pos_1_sodium,580.142820196,JBXDRWCPGRKZIO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 732,6966,-1,,,,0.0,MS1_match,ZPPQIOUITZSYAO-VFRNZNEBSA-O,"InChI=1S/C26H28O15/c27-7-18-20(34)21(35)24(41-25-22(36)19(33)15(32)8-37-25)26(40-18)39-17-6-11-13(30)4-10(28)5-16(11)38-23(17)9-1-2-12(29)14(31)3-9/h1-6,15,18-22,24-27,32-36H,7-8H2,(H3-,28,29,30,31)/p+1/t15-,18+,19+,20+,21-,22+,24-,25-,26+/m0/s1",OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@@H](O[C@@H]2OC[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C26H29O15+,pos_1_sodium,581.15009664809,ZPPQIOUITZSYAO,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Ranunculus asiaticus,658672.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus asiaticus'],6,0,6.0 733,6963,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,pos_1_sodium,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,7.5 734,6963,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,pos_1_sodium,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,3,7.5 735,6963,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,pos_1_sodium,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,3,7.5 736,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 737,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 738,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 739,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-VTFVVPIRSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25+,28+,29-,30-,32-,33+,34+,37-,38+,39+,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@H]5O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,7.5 740,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-FLQGFQTKSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24+,25+,28-,29+,30-,32-,33-,34+,37+,38+,39+,40-,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,3,7.5 741,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-FLQGFQTKSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24+,25+,28-,29+,30-,32-,33-,34+,37+,38+,39+,40-,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,3,7.5 742,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 743,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 744,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 745,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-VTFVVPIRSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25+,28+,29-,30-,32-,33+,34+,37-,38+,39+,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@H]5O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,7.5 746,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-FLQGFQTKSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24+,25+,28-,29+,30-,32-,33-,34+,37+,38+,39+,40-,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,3,7.5 747,6962,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OFQWLDJQLTUOPM-FLQGFQTKSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24+,25+,28-,29+,30-,32-,33-,34+,37+,38+,39+,40-,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,pos_1_sodium,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,3,7.5 748,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 749,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sphaerospermus,1033259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sphaerospermus'],6,3,7.5 750,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis var. diffusus,5264025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 751,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis,491491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 752,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus penicillatus,492327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus penicillatus'],6,3,7.5 753,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 754,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 755,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus rionii,593374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus rionii'],6,3,7.5 756,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BNSCASRSSGJHQH-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-9-4-12(32)16-13(5-9)41-24(8-1-2-10(30)11(31)3-8)25(19(16)35)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,BNSCASRSSGJHQH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 757,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BNSCASRSSGJHQH-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-9-4-12(32)16-13(5-9)41-24(8-1-2-10(30)11(31)3-8)25(19(16)35)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,BNSCASRSSGJHQH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 758,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 759,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 760,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 761,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 762,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 763,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 764,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 765,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 766,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus hederaceus,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 767,6960,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-IROKYFGSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14?,15?,17-,18-,20?,21?,22-,25?,26+,27+/m1/s1",O=c1c(O[C@@H]2OC(CO)[C@@H](O)C(O)C2O[C@@H]2OC(CO)[C@@H](O)C(O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus ololeucos,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 768,6958,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,XNIDEUYQVRRKJJ-FZPNTLRJSA-N,"InChI=1S/C35H34O18/c1-15(36)44-14-27-31(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(52-27)53-32-29(43)28-25(47-18(4)39)12-24(46-17(3)38)13-26(28)51-30(32)22-8-10-23(11-9-22)45-16(2)37/h8-13,27,31,33-35H,14H2,1-7H3/t27-,31-,33+,34-,35+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(OC(C)=O)cc3)oc3cc(OC(C)=O)cc(OC(C)=O)c3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C35H34O18,pos_1_sodium,742.1745142480002,XNIDEUYQVRRKJJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 769,6958,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,XNIDEUYQVRRKJJ-FZPNTLRJSA-N,"InChI=1S/C35H34O18/c1-15(36)44-14-27-31(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(52-27)53-32-29(43)28-25(47-18(4)39)12-24(46-17(3)38)13-26(28)51-30(32)22-8-10-23(11-9-22)45-16(2)37/h8-13,27,31,33-35H,14H2,1-7H3/t27-,31-,33+,34-,35+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(OC(C)=O)cc3)oc3cc(OC(C)=O)cc(OC(C)=O)c3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C35H34O18,pos_1_sodium,742.1745142480002,XNIDEUYQVRRKJJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 770,6956,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_1proton1ammonium,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 771,6956,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_1proton1ammonium,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 772,6956,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_1proton1ammonium,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 773,6955,403,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.5513649,ISDB,SAMOBDXITATWFO-GBQWXGIDSA-N,"InChI=1S/C35H34O18/c36-16-9-20(39)17-11-25(32(50-24(17)10-16)15-3-5-19(38)22(41)8-15)51-35-33(53-34-31(47)28(44)23(42)12-49-34)30(46)29(45)26(52-35)13-48-27(43)6-2-14-1-4-18(37)21(40)7-14/h1-11,23,26,28-31,33-38,40-42,44-47H,12-13H2/t23-,26-,28+,29+,30+,31-,33-,34+,35-/m1/s1",O=C(C=Cc1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc3c(=O)cc(O)cc-3oc2-c2ccc(O)c(O)c2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C35H34O18,,742.174514248,SAMOBDXITATWFO,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Camellia reticulata,83755.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia reticulata'],4,3,7.7054595947265625 774,6955,403,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.5513649,ISDB,SAMOBDXITATWFO-GCNWMLFFSA-N,"InChI=1S/C35H34O18/c36-16-9-20(39)17-11-25(32(50-24(17)10-16)15-3-5-19(38)22(41)8-15)51-35-33(53-34-31(47)28(44)23(42)12-49-34)30(46)29(45)26(52-35)13-48-27(43)6-2-14-1-4-18(37)21(40)7-14/h1-11,23,26,28-31,33-38,40-42,44-47H,12-13H2/t23-,26+,28-,29+,30-,31-,33+,34-,35+/m0/s1",O=C(C=Cc1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc3c(=O)cc(O)cc-3oc2-c2ccc(O)c(O)c2)[C@H](O[C@@H]2OC[C@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,C35H34O18,,742.174514248,SAMOBDXITATWFO,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Begonia,530190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Begoniaceae'],['Unknown'],['Begonia'],['Unknown'],4,3,7.7054595947265625 775,6953,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_1proton,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 776,6953,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_1proton,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 777,6953,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_1proton,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 778,6947,-1,,,,0.23185788,ISDB,,,,,,,UGUPRXALLBSXDM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9274315237998962 779,6943,100,Alkaloids,Naphthalenes,Naphthalenes and derivatives,0.3959682,ISDB,NFKMFHWPFKCYLX-IQOMPXODSA-N,"InChI=1S/C20H25NO6/c1-21-8-7-18-9-12(22)17(25-3)20(26-4)19(18,21)10-14(27-20)11-5-6-13(24-2)16(23)15(11)18/h5-6,14,17,23H,7-10H2,1-4H3/t14-,17+,18-,19-,20-/m0/s1",COc1ccc2c(c1O)[C@@]13CCN(C)[C@@]14C[C@@H]2O[C@@]4(OC)[C@H](OC)C(=O)C3,C20H25NO6,,375.16818752,NFKMFHWPFKCYLX,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Stephania longa,567682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Cissampelideae'],['Stephania'],['Stephania longa'],0,1,2.0838727951049805 780,6940,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.6201703,ISDB,UAEQPGJNTGBPLI-AWEZNQCLSA-N,"InChI=1S/C19H19NO5/c1-24-15-9-11-8-14-13-4-3-12(21)7-10(13)5-6-20(14)19(23)16(11)18(25-2)17(15)22/h3-4,7,9,14,21-22H,5-6,8H2,1-2H3/t14-/m0/s1",COc1cc2c(c(OC)c1O)C(=O)N1CCc3cc(O)ccc3[C@@H]1C2,C19H19NO5,,341.126322708,UAEQPGJNTGBPLI,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Polyalthia longifolia,204189.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Monoon'],['Monoon longifolium'],0,3,3.9806811809539795 781,6939,-1,,,,0.0,MS1_match,XRCRWCVBMHENNE-UHFFFAOYSA-N,"InChI=1S/C14H24O7/c1-3-5-7-20-11(15)9-14(19,13(17)18)10-12(16)21-8-6-4-2/h19H,3-10H2,1-2H3,(H,17,18)",CCCCOC(=O)CC(O)(CC(=O)OCCCC)C(=O)O,C14H24O7,pos_1_1proton1ammonium,304.152203108,XRCRWCVBMHENNE,Fatty acids,Fatty esters,Wax monoesters,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 782,6938,-1,,,,0.0,MS1_match,RTVFIUBAXAZKSU-UHFFFAOYSA-N,"InChI=1S/C22H19NO6/c1-23-8-14-20(18(25-3)7-19-22(14)29-10-28-19)13-6-15(24-2)11-4-16-17(27-9-26-16)5-12(11)21(13)23/h4-7H,8-10H2,1-3H3",COc1cc2c(c3c1-c1cc(OC)c4cc5c(cc4c1N(C)C3)OCO5)OCO2,C22H19NO6,pos_2_2proton1acetonitrile,393.121237328,RTVFIUBAXAZKSU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lucidum,977702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lucidum'],6,0,6.0 783,6930,-1,,,,0.0,MS1_match,GHVNFZFCNZKVNT-UHFFFAOYSA-N,"InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)",CCCCCCCCCC(=O)O,C10H20O2,pos_1_1proton1dmso,172.14632988,GHVNFZFCNZKVNT,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 784,6930,-1,,,,0.0,MS1_match,GHVNFZFCNZKVNT-UHFFFAOYSA-N,"InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)",CCCCCCCCCC(=O)O,C10H20O2,pos_1_1proton1dmso,172.14632988,GHVNFZFCNZKVNT,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 785,6929,458,Terpenoids,Apocarotenoids,Megastigmanes,0.40405548,ISDB,CHEIWKRTMHHGDF-DYMAYKCJSA-N,"InChI=1S/C19H30O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h5-6,11,14-18,20,22-24H,7-9H2,1-4H3/t11-,14-,15-,16+,17-,18-/m1/s1",CC1=C(C=C[C@@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)CC(=O)C1,C19H30O7,,370.1991533,CHEIWKRTMHHGDF,Terpenoids,Apocarotenoids,Megastigmanes,Isodon sculponeatus,1017584.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Isodon'],['Isodon sculponeatus'],4,3,7.116221904754639 786,6925,307,Alkaloids,Tyrosine alkaloids,Benzoquinones,0.0,MS1_match,OLBNOBQOQZRLMP-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-11-6-3-5(9)4-7(12-2)8(6)10/h3-4H,1-2H3",COC1=CC(=O)C=C(OC)C1=O,C8H8O4,pos_1_1proton1isopropanol,168.042258736,OLBNOBQOQZRLMP,Polyketides,Aromatic polyketides,Benzoquinones,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,3,7.5 787,6922,-1,,,,0.0,MS1_match,VBEPBHLFGZQHJK-KNGVKNNDSA-N,"InChI=1S/C23H34O13/c1-10-15(25)17(27)19(29)22(34-10)33-9-14-16(26)18(28)20(30)23(35-14)36-21-12(31-2)7-11(5-4-6-24)8-13(21)32-3/h4-5,7-8,10,14-20,22-30H,6,9H2,1-3H3/b5-4+/t10-,14+,15-,16+,17+,18-,19+,20+,22+,23-/m0/s1",COc1cc(/C=C/CO)cc(OC)c1O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C23H34O13,pos_2_2sodium,518.199941148,VBEPBHLFGZQHJK,Terpenoids,,,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 788,6919,1052,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.0,MS1_match,ACAYJUFAIJJELS-SDQBBNPISA-N,"InChI=1S/C14H15NO2/c1-9(2)4-6-12-11-7-5-10(17-3)8-13(11)15-14(12)16/h4-8H,1-3H3,(H,15,16)/b12-6-",COc1ccc2c(c1)NC(=O)/C2=C\C=C(C)C,C14H15NO2,pos_1_1proton1acetonitrile,229.11027872,ACAYJUFAIJJELS,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,Actaea vaginata,512706.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea vaginata'],6,3,7.5 789,6917,-1,,,,0.23225802,ISDB,URXNJUNXUWLMAY-KZVLYIKRSA-N,"InChI=1S/C27H36O3/c1-20(2)8-5-9-21(3)10-6-11-22(4)12-7-13-23-14-15-24-18-25(27(28)29)16-17-26(24)30-19-23/h8,10,12,14,16-18H,5-7,9,11,13,15,19H2,1-4H3,(H,28,29)/b21-10+,22-12+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC1=CCc2cc(C(=O)O)ccc2OC1,C27H36O3,,408.2664450119999,URXNJUNXUWLMAY,Terpenoids,Meroterpenoids,Merosesquiterpenoids,Callophycus serratus,336004.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Callophycus'],['Callophycus serratus'],2,0,2.92903208732605 790,6910,-1,,,,0.0,MS1_match,ILEDWLMCKZNDJK-UHFFFAOYSA-N,"InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H",O=c1ccc2cc(O)c(O)cc2o1,C9H6O4,pos_1_1proton1acetonitrile,178.026608672,ILEDWLMCKZNDJK,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,0,6.0 791,6908,-1,,,,0.0,MS1_match,RTVFIUBAXAZKSU-UHFFFAOYSA-N,"InChI=1S/C22H19NO6/c1-23-8-14-20(18(25-3)7-19-22(14)29-10-28-19)13-6-15(24-2)11-4-16-17(27-9-26-16)5-12(11)21(13)23/h4-7H,8-10H2,1-3H3",COc1cc2c(c3c1-c1cc(OC)c4cc5c(cc4c1N(C)C3)OCO5)OCO2,C22H19NO6,pos_2_2proton1acetonitrile,393.121237328,RTVFIUBAXAZKSU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lucidum,977702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lucidum'],6,0,6.0 792,6907,633,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Furocoumarins,0.0,MS1_match,SWHQTQFJVVJCQA-QMMMGPOBSA-N,"InChI=1S/C15H16O4/c1-7-9(16)5-6-10-11(7)13-12(14(17)19-10)15(3,4)8(2)18-13/h5-6,8,16H,1-4H3/t8-/m0/s1",Cc1c(O)ccc2oc(=O)c3c(c12)O[C@@H](C)C3(C)C,C15H16O4,pos_1_1proton1ammonium,260.104858992,SWHQTQFJVVJCQA,Shikimates and Phenylpropanoids,Coumarins,Furocoumarins,Glaucidium palmatum,889044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Glaucidium'],['Glaucidium palmatum'],6,3,7.5 793,6904,-1,,,,0.51978165,ISDB,OZCJIHCANLYTSI-UHFFFAOYSA-N,"InChI=1S/C11H9NO3/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13/h2-5H,6H2,1H3",Cn1ccc2cc3c(cc2c1=O)OCO3,C11H9NO3,,203.058243148,OZCJIHCANLYTSI,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Doryphora sassafras,162496.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Atherospermataceae'],['Unknown'],['Doryphora'],['Doryphora sassafras'],4,0,6.079126596450806 794,6904,-1,,,,0.51978165,ISDB,OZCJIHCANLYTSI-UHFFFAOYSA-N,"InChI=1S/C11H9NO3/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13/h2-5H,6H2,1H3",Cn1ccc2cc3c(cc2c1=O)OCO3,C11H9NO3,,203.058243148,OZCJIHCANLYTSI,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Cryptocarya chinensis,445161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Cryptocarya'],['Cryptocarya chinensis'],4,0,6.079126596450806 795,6901,-1,,,,0.7823456,ISDB,YDDGKXBLOXEEMN-XAKUNQSDSA-N,"InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O,C22H18O12,,474.0798260159999,YDDGKXBLOXEEMN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,10.129382371902466 796,6899,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.59199685,ISDB,DBHKHNGBVGWQJE-USWSLJGRSA-N,"InChI=1S/C23H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h6-7,9-10,22,25H,2-5,8,11-21,24H2,1H3,(H,27,28)/b7-6-,10-9-/t22-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OCCN,C23H44NO7P,,477.285539378,DBHKHNGBVGWQJE,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,0,6.367987394332886 797,6895,-1,,,,0.0,MS1_match,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,pos_1_1proton1ammonium,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 798,6895,-1,,,,0.0,MS1_match,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,pos_1_1proton1ammonium,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 799,6895,-1,,,,0.0,MS1_match,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,pos_1_1proton1ammonium,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,0,6.0 800,6895,-1,,,,0.0,MS1_match,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,pos_1_1proton1ammonium,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,0,6.0 801,6895,-1,,,,0.0,MS1_match,IXJHFORJGDOBHK-IFNLGUEUSA-N,"InChI=1S/C26H28O12/c1-3-10(2)26(35)38-25-22(34)21(33)18(9-27)37-24(25)20-15(31)7-14(30)19-16(32)8-17(36-23(19)20)11-4-5-12(28)13(29)6-11/h4-8,10,18,21-22,24-25,27-31,33-34H,3,9H2,1-2H3/t10-,18-,21-,22+,24+,25-/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc12,C26H28O12,pos_2_2proton2acetonitrile,532.158076336,IXJHFORJGDOBHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 802,6895,-1,,,,0.0,MS1_match,IXJHFORJGDOBHK-IFNLGUEUSA-N,"InChI=1S/C26H28O12/c1-3-10(2)26(35)38-25-22(34)21(33)18(9-27)37-24(25)20-15(31)7-14(30)19-16(32)8-17(36-23(19)20)11-4-5-12(28)13(29)6-11/h4-8,10,18,21-22,24-25,27-31,33-34H,3,9H2,1-2H3/t10-,18-,21-,22+,24+,25-/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc12,C26H28O12,pos_2_2proton2acetonitrile,532.158076336,IXJHFORJGDOBHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 803,6895,-1,,,,0.0,MS1_match,RFYWLSPBFOYSRV-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-5-8-1-2-10-13(20-7-8)4-12(19)14-11(18)3-9(6-17)21-15(10)14/h1,3-4,16-17,19H,2,5-7H2",O=c1cc(CO)oc2c3c(cc(O)c12)OCC(CO)=CC3,C15H14O6,pos_1_1proton1ammonium,290.079038168,RFYWLSPBFOYSRV,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 804,6895,-1,,,,0.0,MS1_match,RFYWLSPBFOYSRV-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-5-8-1-2-10-13(20-7-8)4-12(19)14-11(18)3-9(6-17)21-15(10)14/h1,3-4,16-17,19H,2,5-7H2",O=c1cc(CO)oc2c3c(cc(O)c12)OCC(CO)=CC3,C15H14O6,pos_1_1proton1ammonium,290.079038168,RFYWLSPBFOYSRV,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 805,6895,-1,,,,0.0,MS1_match,OGUZXOYWHIKKNX-OAHLLOKOSA-N,"InChI=1S/C15H14O6/c1-8-4-10(17)13-11(18)5-12-9(14(13)21-8)2-3-15(19,6-16)7-20-12/h2-5,16,18-19H,6-7H2,1H3/t15-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO)CO3,C15H14O6,pos_1_1proton1ammonium,290.079038168,OGUZXOYWHIKKNX,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 806,6895,-1,,,,0.0,MS1_match,OGUZXOYWHIKKNX-OAHLLOKOSA-N,"InChI=1S/C15H14O6/c1-8-4-10(17)13-11(18)5-12-9(14(13)21-8)2-3-15(19,6-16)7-20-12/h2-5,16,18-19H,6-7H2,1H3/t15-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO)CO3,C15H14O6,pos_1_1proton1ammonium,290.079038168,OGUZXOYWHIKKNX,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 807,6892,307,Alkaloids,Tyrosine alkaloids,Benzoquinones,0.57845104,ISDB,SPIWINZXMDJUPE-UHFFFAOYSA-N,"InChI=1S/C15H17NO2/c1-10(2)8-9-12-14(18-3)11-6-4-5-7-13(11)16-15(12)17/h4-8H,9H2,1-3H3,(H,16,17)",COc1c(CC=C(C)C)c(O)nc2ccccc12,C15H17NO2,,243.125928784,SPIWINZXMDJUPE,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum wutaiense,570620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum wutaiense'],4,1,6.8138041496276855 808,6892,307,Alkaloids,Tyrosine alkaloids,Benzoquinones,0.57845104,ISDB,SPIWINZXMDJUPE-UHFFFAOYSA-N,"InChI=1S/C15H17NO2/c1-10(2)8-9-12-14(18-3)11-6-4-5-7-13(11)16-15(12)17/h4-8H,9H2,1-3H3,(H,16,17)",COc1c(CC=C(C)C)c(O)nc2ccccc12,C15H17NO2,,243.125928784,SPIWINZXMDJUPE,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum integrifoliolum,6125676.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum integrifoliolum'],4,1,6.8138041496276855 809,6892,307,Alkaloids,Tyrosine alkaloids,Benzoquinones,0.57845104,ISDB,SPIWINZXMDJUPE-UHFFFAOYSA-N,"InChI=1S/C15H17NO2/c1-10(2)8-9-12-14(18-3)11-6-4-5-7-13(11)16-15(12)17/h4-8H,9H2,1-3H3,(H,16,17)",COc1c(CC=C(C)C)c(O)nc2ccccc12,C15H17NO2,,243.125928784,SPIWINZXMDJUPE,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum zanthoxyloides,6125784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum zanthoxyloides'],4,1,6.8138041496276855 810,6892,307,Alkaloids,Tyrosine alkaloids,Benzoquinones,0.57845104,ISDB,SPIWINZXMDJUPE-UHFFFAOYSA-N,"InChI=1S/C15H17NO2/c1-10(2)8-9-12-14(18-3)11-6-4-5-7-13(11)16-15(12)17/h4-8H,9H2,1-3H3,(H,16,17)",COc1c(CC=C(C)C)c(O)nc2ccccc12,C15H17NO2,,243.125928784,SPIWINZXMDJUPE,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Euodia rutaecarpa,976536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Tetradium'],['Tetradium ruticarpum'],4,1,6.8138041496276855 811,6892,307,Alkaloids,Tyrosine alkaloids,Benzoquinones,0.57845104,ISDB,SPIWINZXMDJUPE-UHFFFAOYSA-N,"InChI=1S/C15H17NO2/c1-10(2)8-9-12-14(18-3)11-6-4-5-7-13(11)16-15(12)17/h4-8H,9H2,1-3H3,(H,16,17)",COc1c(CC=C(C)C)c(O)nc2ccccc12,C15H17NO2,,243.125928784,SPIWINZXMDJUPE,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Ravenia spectabilis,5762706.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Ravenia'],['Ravenia spectabilis'],4,1,6.8138041496276855 812,6886,295,Terpenoids,Steroids,Estrane steroids,0.6240285,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.996114015579224 813,6885,-1,,,,0.24547504,ISDB,NTWKCDCNZLHNHW-UHFFFAOYSA-N,"InChI=1S/C14H13NO3/c1-3-15-12-8-9(17-2)4-5-10(12)13(16)11-6-7-18-14(11)15/h4-8H,3H2,1-2H3",CCn1c2cc(OC)ccc2c(=O)c2ccoc21,C14H13NO3,,243.089543276,NTWKCDCNZLHNHW,Alkaloids,Anthranilic acid alkaloids,Acridone alkaloids,Ruta chalepensis,504804.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Ruta'],['Ruta chalepensis'],4,0,4.981900155544281 814,6882,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.38937995,ISDB,WOJHWCSDXFDSLY-UHFFFAOYSA-N,"InChI=1S/C14H13NO3/c1-3-17-13-9-5-4-6-11(16-2)12(9)15-14-10(13)7-8-18-14/h4-8H,3H2,1-2H3",CCOc1c2ccoc2nc2c(OC)cccc12,C14H13NO3,,243.089543276,WOJHWCSDXFDSLY,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Dictamnus albus,568898.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Dictamnus'],['Dictamnus albus'],4,3,7.057519793510437 815,6880,-1,,,,0.0,MS1_match,CIDJXBNFIKRPHX-UHFFFAOYSA-N,"InChI=1S/C13H12O3/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13-16H",Oc1ccc(C(O)c2ccc(O)cc2)cc1,C13H12O3,pos_1_1proton1acetonitrile,216.078644244,CIDJXBNFIKRPHX,Shikimates and Phenylpropanoids,,,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 816,6876,633,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Furocoumarins,0.22470856,ISDB,DWGJDUGVGKBCGA-LBPRGKRZSA-N,"InChI=1S/C15H17NO3/c1-15(2)12(17)8-10-13(19-15)9-6-4-5-7-11(9)16(3)14(10)18/h4-7,12,17H,8H2,1-3H3/t12-/m0/s1",Cn1c(=O)c2c(c3ccccc31)OC(C)(C)[C@@H](O)C2,C15H17NO3,,259.120843404,DWGJDUGVGKBCGA,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Skimmia laureola,186515.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Skimmia'],['Skimmia laureola'],4,2,5.898834228515625 817,6874,-1,,,,0.0,MS1_match,HSUIVCLOAAJSRE-UHFFFAOYSA-N,"InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3",COCCOC(=O)c1ccccc1C(=O)OCCOC,C14H18O6,pos_2MNa,282.110338296,HSUIVCLOAAJSRE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 818,6870,-1,,,,0.34036824,ISDB,VSPBJCAGAJBGKS-UHFFFAOYSA-N,"InChI=1S/C9H14N4O6/c10-6-5(7(17)13-9(11)12-6)19-8-4(16)3(15)2(14)1-18-8/h2-4,8,14-16H,1H2,(H5,10,11,12,13,17)",N=c1nc(O)c(OC2OCC(O)C(O)C2O)c(N)[nH]1,C9H14N4O6,,274.091334168,VSPBJCAGAJBGKS,,,,Momordica charantia,955521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Momordiceae'],['Momordica'],['Momordica charantia'],4,0,5.361472964286804 819,6868,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,LHSMCOYXDSMPQS-ULBWLWKQSA-N,"InChI=1S/C21H27NO4/c1-9-5-20-6-11(23)16-19(2)8-22(3)17-14(20)15(25)10(9)4-13(20)21(16,17)7-12(24)18(19)26/h10,12-14,16-18,24,26H,1,4-8H2,2-3H3/t10-,12+,13+,14+,16+,17+,18+,19-,20+,21+/m0/s1",C=C1C[C@]23CC(=O)[C@@H]4[C@]5(C)CN(C)[C@@H]6[C@H]2C(=O)[C@H]1C[C@H]3[C@]46C[C@@H](O)[C@H]5O,C21H27NO4,pos_1_1proton,357.194008344,LHSMCOYXDSMPQS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium albiflorum,6131751.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium albiflorum'],6,1,6.5 820,6868,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,LHSMCOYXDSMPQS-UHFFFAOYSA-N,"InChI=1S/C21H27NO4/c1-9-5-20-6-11(23)16-19(2)8-22(3)17-14(20)15(25)10(9)4-13(20)21(16,17)7-12(24)18(19)26/h10,12-14,16-18,24,26H,1,4-8H2,2-3H3",C=C1CC23CC(=O)C4C5(C)CN(C)C6C2C(=O)C1CC3C64CC(O)C5O,C21H27NO4,pos_1_1proton,357.194008344,LHSMCOYXDSMPQS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum heterophyllum,124446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum heterophyllum'],6,1,6.5 821,6867,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,AOCLIMDHBMBYGD-NQWMYEDTSA-N,"InChI=1S/C16H28O2/c1-10-8-12(17)13-15(10,4)9-11-6-7-16(13,5)18-14(11,2)3/h10-13,17H,6-9H2,1-5H3/t10-,11-,12-,13-,15-,16+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@]1(C)C[C@H]1CC[C@]2(C)OC1(C)C,C16H28O2,pos_2_1proton1sodium,252.208930136,AOCLIMDHBMBYGD,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 822,6864,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,KEFSSCNIGGZESY-LHEBDDKOSA-N,"InChI=1S/C32H40O13/c1-7-17(2)26(35)44-25-22(42-27(36)19-8-10-39-14-19)13-30(6,38)32-24(34)21(29(4,5)45-32)12-23(31(25,32)16-41-18(3)33)43-28(37)20-9-11-40-15-20/h8-11,14-15,17,21-25,34,38H,7,12-13,16H2,1-6H3/t17-,21-,22+,23+,24-,25+,30+,31-,32+/m1/s1",CC[C@@H](C)C(=O)O[C@H]1[C@@H](OC(=O)c2ccoc2)C[C@](C)(O)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccoc4)[C@]12COC(C)=O)[C@H]3O,C32H40O13,pos_2_1proton1sodium,632.24689134,KEFSSCNIGGZESY,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],8,2,9.0 823,6864,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,CQFLWUBGIUDNJS-UHFFFAOYSA-N,"InChI=1S/C32H40O13/c1-16-14-23(40-18(3)34)26(41-19(4)35)31(15-39-17(2)33)28(43-21(6)37)25(44-29(38)22-12-10-9-11-13-22)24-27(42-20(5)36)32(16,31)45-30(24,7)8/h9-13,16,23-28H,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)C13OC(C)(C)C(C(OC(=O)c1ccccc1)C2OC(C)=O)C3OC(C)=O,C32H40O13,pos_2_1proton1sodium,632.24689134,CQFLWUBGIUDNJS,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],8,2,9.0 824,6864,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,CQFLWUBGIUDNJS-UHFFFAOYSA-N,"InChI=1S/C32H40O13/c1-16-14-23(40-18(3)34)26(41-19(4)35)31(15-39-17(2)33)28(43-21(6)37)25(44-29(38)22-12-10-9-11-13-22)24-27(42-20(5)36)32(16,31)45-30(24,7)8/h9-13,16,23-28H,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)C13OC(C)(C)C(C(OC(=O)c1ccccc1)C2OC(C)=O)C3OC(C)=O,C32H40O13,pos_2_1proton1sodium,632.24689134,CQFLWUBGIUDNJS,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],8,2,9.0 825,6860,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.21355532,ISDB,RPIFZBLUZMLYHZ-UHFFFAOYSA-N,"InChI=1S/C21H22O6/c1-3-26-21(24)13-7-15-4-9-17(10-5-15)27-19-14-16(6-11-18(19)22)8-12-20(23)25-2/h4-6,8-12,14,22H,3,7,13H2,1-2H3",CCOC(=O)CCc1ccc(Oc2cc(C=CC(=O)OC)ccc2O)cc1,C21H22O6,,370.141638424,RPIFZBLUZMLYHZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Spiraea formosana,258075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Spiraeeae'],['Spiraea'],['Spiraea formosana'],4,3,6.354221284389496 826,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum zanthoxyloides,6125784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum zanthoxyloides'],4,3,8.116095781326294 827,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Micromelum minutum,1016453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Micromelum'],['Micromelum minutum'],4,3,8.116095781326294 828,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Neoraputia paraensis,6126505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Neoraputia'],['Neoraputia paraensis'],4,3,8.116095781326294 829,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum thesioides,793118.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum thesioides'],4,3,8.116095781326294 830,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum chalybeum,5762613.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum chalybeum'],4,3,8.116095781326294 831,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum chalybaeum,6125630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum chalybaeum'],4,3,8.116095781326294 832,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Helietta apiculata,5747575.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Helietta'],['Helietta apiculata'],4,3,8.116095781326294 833,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Geijera balansae,6126353.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Geijera'],['Geijera balansae'],4,3,8.116095781326294 834,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum integrifoliolum,6125676.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum integrifoliolum'],4,3,8.116095781326294 835,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum suaveolens,397688.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum suaveolens'],4,3,8.116095781326294 836,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum tuberculatum,1081353.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum tuberculatum'],4,3,8.116095781326294 837,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum simulans,889927.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum simulans'],4,3,8.116095781326294 838,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum beecheyanum,743556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum beecheyanum'],4,3,8.116095781326294 839,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum bucharicum,1046433.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum bucharicum'],4,3,8.116095781326294 840,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum acutifolium,239196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum acutifolium'],4,3,8.116095781326294 841,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum coco,5747726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum coco'],4,3,8.116095781326294 842,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Flindersia australis,81672.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Flindersia'],['Flindersia australis'],4,3,8.116095781326294 843,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum heitzii,6125670.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum heitzii'],4,3,8.116095781326294 844,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum nitidum,164612.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum nitidum'],4,3,8.116095781326294 845,6859,1113,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.65402395,ISDB,PXNMNABLQWUMCX-UHFFFAOYSA-N,"InChI=1S/C14H13NO2/c1-14(2)8-7-10-12(17-14)9-5-3-4-6-11(9)15-13(10)16/h3-8H,1-2H3,(H,15,16)",CC1(C)C=Cc2c(O)nc3ccccc3c2O1,C14H13NO2,,227.094628656,PXNMNABLQWUMCX,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Glycosmis parviflora,181666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Glycosmis'],['Glycosmis parviflora'],4,3,8.116095781326294 846,6851,-1,,,,0.4557366,ISDB,DHRIZUTVXJEWCC-UHFFFAOYSA-N,"InChI=1S/C22H22O10/c1-28-12-6-17(29-2)19-14(25)8-16(31-18(19)7-12)11-3-4-15(13(24)5-11)32-21-20(26)22(27,9-23)10-30-21/h3-8,20-21,23-24,26-27H,9-10H2,1-2H3",COc1cc(OC)c2c(=O)cc(-c3ccc(OC4OCC(O)(CO)C4O)c(O)c3)oc2c1,C22H22O10,,446.121296904,DHRIZUTVXJEWCC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Strobilanthes formosana,119923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Acanthaceae'],['Ruellieae'],['Strobilanthes'],['Strobilanthes formosana'],4,0,5.8229464292526245 847,6849,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.6652844,ISDB,QFIHQWXKTUONPL-UHFFFAOYSA-N,"InChI=1S/C18H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h14-17H,2-13H2,1H3,(H2,19,20)",CCCCCCCCCCCCCC=CC=CC(N)=O,C18H33NO,,279.256214676,QFIHQWXKTUONPL,,,,Piper longum,97780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper longum'],4,0,6.661137580871582 848,6848,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_2MH,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 849,6839,1207,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HRAKXIGVAPGHEW-XHHYMNQSSA-N,"InChI=1S/C21H36O10/c1-10(2)5-16(24)31-15-6-12(11(3)7-22)13(21(15,4)28)9-29-20-19(27)18(26)17(25)14(8-23)30-20/h10,12-15,17-20,22-23,25-28H,3,5-9H2,1-2,4H3/t12-,13+,14-,15+,17-,18+,19-,20-,21+/m1/s1",C=C(CO)[C@H]1C[C@H](OC(=O)CC(C)C)[C@@](C)(O)[C@H]1CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H36O10,pos_1_1proton1ethylamine,448.23084735199984,HRAKXIGVAPGHEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 850,6839,1207,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HRAKXIGVAPGHEW-XHHYMNQSSA-N,"InChI=1S/C21H36O10/c1-10(2)5-16(24)31-15-6-12(11(3)7-22)13(21(15,4)28)9-29-20-19(27)18(26)17(25)14(8-23)30-20/h10,12-15,17-20,22-23,25-28H,3,5-9H2,1-2,4H3/t12-,13+,14-,15+,17-,18+,19-,20-,21+/m1/s1",C=C(CO)[C@H]1C[C@H](OC(=O)CC(C)C)[C@@](C)(O)[C@H]1CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H36O10,pos_1_1proton1ethylamine,448.23084735199984,HRAKXIGVAPGHEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 851,6831,-1,,,,0.0,MS1_match,RPOWAISXPHIEJS-XAVNFNALSA-N,"InChI=1S/C10H16O4/c1-5-6-3-8(11)10(2,13)7(6)4-14-9(5)12/h5-8,11,13H,3-4H2,1-2H3/t5-,6-,7+,8+,10+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O,C10H16O4,pos_1_1proton1acetonitrile,200.104858992,RPOWAISXPHIEJS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 852,6831,-1,,,,0.0,MS1_match,RPOWAISXPHIEJS-QKDRXXQKSA-N,"InChI=1S/C10H16O4/c1-5-6-3-8(11)10(2,13)7(6)4-14-9(5)12/h5-8,11,13H,3-4H2,1-2H3/t5-,6?,7?,8+,10+/m1/s1",C[C@H]1C(=O)OCC2C1C[C@H](O)[C@@]2(C)O,C10H16O4,pos_1_1proton1acetonitrile,200.104858992,RPOWAISXPHIEJS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 853,6831,-1,,,,0.0,MS1_match,PEZCHMXCLXLNIE-UHFFFAOYSA-N,"InChI=1S/C10H16O4/c1-5-4-14-9(12)8-6(5)3-7(11)10(8,2)13/h5-8,11,13H,3-4H2,1-2H3",CC1COC(=O)C2C1CC(O)C2(C)O,C10H16O4,pos_1_1proton1acetonitrile,200.104858992,PEZCHMXCLXLNIE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 854,6831,-1,,,,0.0,MS1_match,AKSVFQUZZNWLCZ-QWABEJFVSA-N,"InChI=1S/C10H16O4/c1-5-6-3-8(12)10(2,13)9(6)14-4-7(5)11/h5-6,8-9,12-13H,3-4H2,1-2H3/t5-,6-,8+,9+,10-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O,C10H16O4,pos_1_1proton1acetonitrile,200.104858992,AKSVFQUZZNWLCZ,Polyketides,,,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 855,6831,-1,,,,0.0,MS1_match,STSJHYHSVQPPEC-BGKGJTHRSA-N,"InChI=1S/C10H16O4/c1-5-4-14-10(13)9-6(5)2-8(12)7(9)3-11/h5-9,11-12H,2-4H2,1H3/t5-,6+,7-,8-,9-/m0/s1",C[C@H]1COC(=O)[C@@H]2[C@@H](CO)[C@@H](O)C[C@@H]21,C10H16O4,pos_1_1proton1acetonitrile,200.104858992,STSJHYHSVQPPEC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 856,6829,-1,,,,0.34079492,ISDB,RKAXZSIBGORDGB-UHFFFAOYSA-N,"InChI=1S/C22H24O5/c1-13(2)16(23)10-15-19(25-3)12-20(26-4)21-17(24)11-18(27-22(15)21)14-8-6-5-7-9-14/h5-9,12,16,18,23H,1,10-11H2,2-4H3",C=C(C)C(O)Cc1c(OC)cc(OC)c2c1OC(c1ccccc1)CC2=O,C22H24O5,,368.162373868,RKAXZSIBGORDGB,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Pongamia glabra,170183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Millettieae'],['Pongamia'],['Pongamia pinnata'],4,0,5.363179683685303 857,6829,-1,,,,0.34079492,ISDB,RKAXZSIBGORDGB-WMZOPIPTSA-N,"InChI=1S/C22H24O5/c1-13(2)16(23)10-15-19(25-3)12-20(26-4)21-17(24)11-18(27-22(15)21)14-8-6-5-7-9-14/h5-9,12,16,18,23H,1,10-11H2,2-4H3/t16-,18-/m0/s1",C=C(C)[C@@H](O)Cc1c(OC)cc(OC)c2c1O[C@H](c1ccccc1)CC2=O,C22H24O5,,368.1623738679999,RKAXZSIBGORDGB,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Pongamia pinnata,170183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Millettieae'],['Pongamia'],['Pongamia pinnata'],4,0,5.363179683685303 858,6829,-1,,,,0.34079492,ISDB,RKAXZSIBGORDGB-UHFFFAOYSA-N,"InChI=1S/C22H24O5/c1-13(2)16(23)10-15-19(25-3)12-20(26-4)21-17(24)11-18(27-22(15)21)14-8-6-5-7-9-14/h5-9,12,16,18,23H,1,10-11H2,2-4H3",C=C(C)C(O)Cc1c(OC)cc(OC)c2c1OC(c1ccccc1)CC2=O,C22H24O5,,368.162373868,RKAXZSIBGORDGB,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Pongamia pinnata var. pinnata,7633049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Millettieae'],['Pongamia'],['Pongamia pinnata'],4,0,5.363179683685303 859,6829,-1,,,,0.34079492,ISDB,RKAXZSIBGORDGB-UHFFFAOYSA-N,"InChI=1S/C22H24O5/c1-13(2)16(23)10-15-19(25-3)12-20(26-4)21-17(24)11-18(27-22(15)21)14-8-6-5-7-9-14/h5-9,12,16,18,23H,1,10-11H2,2-4H3",C=C(C)C(O)Cc1c(OC)cc(OC)c2c1OC(c1ccccc1)CC2=O,C22H24O5,,368.162373868,RKAXZSIBGORDGB,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Millettia pinnata,170183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Millettieae'],['Pongamia'],['Pongamia pinnata'],4,0,5.363179683685303 860,6828,590,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.3322751,ISDB,LAXQYRRMGGEGOH-JXRLJXCWSA-N,"InChI=1S/C28H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(31)34-25-27(30)26-36-37(32,33)35-24-23-29(2,3)4/h9-10,12-13,15-16,18-19,27,30H,5-8,11,14,17,20-26H2,1-4H3/b10-9-,13-12-,16-15-,19-18-/t27-/m1/s1",CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C28H50NO7P,,543.33248957,LAXQYRRMGGEGOH,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,3,3.8291003704071045 861,6826,864,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,0.560782,ISDB,HBWSHUSCJAVGEJ-IJLUTSLNSA-N,"InChI=1S/C15H21NO6/c17-13-10(1-4-20-13)7-16(8-11-2-5-21-14(11)18)9-12-3-6-22-15(12)19/h10-12H,1-9H2/t10-,11-,12-/m1/s1",O=C1OCC[C@@H]1CN(C[C@H]1CCOC1=O)C[C@H]1CCOC1=O,C15H21NO6,,311.136887392,HBWSHUSCJAVGEJ,,,,Bellendena montana,551480.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Proteales'],['Proteaceae'],['Unknown'],['Bellendena'],['Bellendena montana'],4,0,6.243128061294556 862,6825,-1,,,,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_2MNa,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 863,6823,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.6377615,ISDB,KVRQQFBSAHPTAB-ATLLRHMBSA-N,"InChI=1S/C11H18O9/c1-4(5(14)2-12)10(18)20-11-9(17)8(16)7(15)6(3-13)19-11/h5-9,11-17H,1-3H2/t5-,6-,7-,8+,9-,11+/m1/s1",C=C(C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C11H18O9,,294.095082156,KVRQQFBSAHPTAB,Fatty acids,Fatty acyl glycosides,Fatty acyl glycosides of mono- and disaccharides,Tulipa gesneriana,878707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Tulipa'],['Tulipa gesneriana'],4,0,6.551045894622803 864,6821,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.68295443,ISDB,,,,,,,QGQZZVMZZMLDQI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.7318177223205566 865,6819,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 866,6816,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7001344,ISDB,IHQUEBHATOOKPN-UHFFFAOYSA-N,"InChI=1S/C14H22/c1-9-7-8-10-5-4-6-11-13(12(9)10)14(11,2)3/h4-5,9-13H,6-8H2,1-3H3",CC1CCC2C=CCC3C(C12)C3(C)C,C14H22,,190.172150704,IHQUEBHATOOKPN,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Cyperus rotundus,338773.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Cyperaceae'],['Cypereae'],['Cyperus'],['Cyperus rotundus'],4,2,7.800537586212158 867,6816,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7001344,ISDB,IHQUEBHATOOKPN-UHFFFAOYSA-N,"InChI=1S/C14H22/c1-9-7-8-10-5-4-6-11-13(12(9)10)14(11,2)3/h4-5,9-13H,6-8H2,1-3H3",CC1CCC2C=CCC3C(C12)C3(C)C,C14H22,,190.172150704,IHQUEBHATOOKPN,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Clausena excavata,571298.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Clausena'],['Clausena excavata'],4,2,7.800537586212158 868,6816,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7001344,ISDB,IHQUEBHATOOKPN-UHFFFAOYSA-N,"InChI=1S/C14H22/c1-9-7-8-10-5-4-6-11-13(12(9)10)14(11,2)3/h4-5,9-13H,6-8H2,1-3H3",CC1CCC2C=CCC3C(C12)C3(C)C,C14H22,,190.172150704,IHQUEBHATOOKPN,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Ursinia speciosa,773007.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Ursinia'],['Ursinia speciosa'],4,2,7.800537586212158 869,6815,92,Polyketides,Phenylpropanoids (C6-C3),Macrolide lactones,0.0,MS1_match,CTRDXWHAKGQMPY-GARJFASQSA-N,"InChI=1S/C12H22O4/c1-9-6-4-2-3-5-7-10(13)11(14)8-12(15)16-9/h9-11,13-14H,2-8H2,1H3/t9-,10-,11+/m0/s1",C[C@H]1CCCCCC[C@H](O)[C@H](O)CC(=O)O1,C12H22O4,pos_1_1proton1acetonitrile,230.151809184,CTRDXWHAKGQMPY,Polyketides,Macrolides,Macrolide lactones,Gymnosporia acuminata,906995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus hookeri'],6,3,7.5 870,6809,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.2356907,ISDB,FPQQKAKTGXPOSV-DYNHENLKSA-N,"InChI=1S/C28H36/c1-18(2)19(3)10-11-20(4)25-14-15-26-23-13-12-22-9-7-8-21(5)27(22)24(23)16-17-28(25,26)6/h7-13,15,18-20,25H,14,16-17H2,1-6H3/b11-10+/t19-,20-,25-,28-/m1/s1",Cc1cccc2ccc3c(c12)CC[C@@]1(C)C3=CC[C@@H]1[C@H](C)/C=C/[C@@H](C)C(C)C,C28H36,,372.281701152,FPQQKAKTGXPOSV,Terpenoids,Steroids,Ergostane steroids,Daldinia concentrica,183726.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Xylariales'],['Xylariaceae'],['Unknown'],['Daldinia'],['Daldinia concentrica'],1,1,2.442762792110443 871,6807,751,Fatty acids,Fatty Acids and Conjugates,Carbocyclic fatty acids,0.35383677,ISDB,,,,,,,LSASWUQIGCOCHW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4153470993041992 872,6806,-1,,,,0.48381642,ISDB,,,,,,,RTDIKSCKKJORSI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.9352656602859497 873,6800,97,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.2202239,ISDB,,,,,,,DMBWITJKQWBTJB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8808956146240234 874,6799,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_2MK,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 875,6797,-1,,,,0.6236931,ISDB,BHLLOBXLOWXZDQ-UHFFFAOYSA-N,"InChI=1S/C22H27NO7/c1-23-8-7-12-9-16-21(30-11-29-16)22(28-4)17(12)18(23)19(25)13-5-6-15(26-2)20(27-3)14(13)10-24/h5-6,9,18-19,24-25H,7-8,10-11H2,1-4H3",COc1ccc(C(O)C2c3c(cc4c(c3OC)OCO4)CCN2C)c(CO)c1OC,C22H27NO7,,417.178752204,BHLLOBXLOWXZDQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver orientale,171970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver orientale'],4,0,6.494772434234619 876,6797,-1,,,,0.6236931,ISDB,BHLLOBXLOWXZDQ-UHFFFAOYSA-N,"InChI=1S/C22H27NO7/c1-23-8-7-12-9-16-21(30-11-29-16)22(28-4)17(12)18(23)19(25)13-5-6-15(26-2)20(27-3)14(13)10-24/h5-6,9,18-19,24-25H,7-8,10-11H2,1-4H3",COc1ccc(C(O)C2c3c(cc4c(c3OC)OCO4)CCN2C)c(CO)c1OC,C22H27NO7,,417.178752204,BHLLOBXLOWXZDQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver pseudo-orientale,237513.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver pseudo-orientale'],4,0,6.494772434234619 877,6793,479,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,0.6599913,ISDB,HBZNVZIRJWODIB-NHCUFCNUSA-N,"InChI=1S/C39H74NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,37H,3-10,12,14-16,19-36,40H2,1-2H3,(H,43,44)/b13-11-,18-17-/t37-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCCN,C39H74NO8P,,715.515204958,HBZNVZIRJWODIB,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,8.139965295791626 878,6793,479,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,0.6599913,ISDB,HBZNVZIRJWODIB-NHCUFCNUSA-N,"InChI=1S/C39H74NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,37H,3-10,12,14-16,19-36,40H2,1-2H3,(H,43,44)/b13-11-,18-17-/t37-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCCN,C39H74NO8P,,715.515204958,HBZNVZIRJWODIB,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Lycoris incarnata,992964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Lycoris'],['Lycoris incarnata'],4,3,8.139965295791626 879,6792,242,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MNTSOBLYWJLVEK-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-25(39-27(29)10-16)14-1-4-18(5-2-14)38-24-6-3-15(7-19(24)33)26-13-23(37)30-21(35)9-17(32)11-28(30)40-26/h1-13,31-35H",O=c1cc(-c2ccc(Oc3ccc(-c4cc(=O)c5c(O)cc(O)cc5o4)cc3O)cc2)oc2cc(O)cc(O)c12,C30H18O10,pos_1_1proton,538.089996776,MNTSOBLYWJLVEK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 880,6792,242,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,NNPGECDACGBKDH-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-13,31-35H",O=c1cc(-c2ccc(Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O)cc2)oc2cc(O)cc(O)c12,C30H18O10,pos_1_1proton,538.0899967759999,NNPGECDACGBKDH,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 881,6791,-1,,,,0.0,MS1_match,JLXTZXSQSXGVTK-UHFFFAOYSA-N,"InChI=1S/C11H14N2O4/c1-7-4-5-8(12-10(14)16-2)9(6-7)13-11(15)17-3/h4-6H,1-3H3,(H,12,14)(H,13,15)",COC(=O)Nc1ccc(C)cc1NC(=O)OC,C11H14N2O4,pos_2MNa,238.095356928,JLXTZXSQSXGVTK,Amino acids and Peptides,Small peptides,Aminoacids,Delphinium cuneatum,753190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cuneatum'],6,0,6.0 882,6791,-1,,,,0.0,MS1_match,AVGYGFTXSUAKEM-RWRFEADFSA-N,"InChI=1S/C41H47NO20/c1-18-25-10-12-42-14-26(25)35(49)55-16-37(7)27-28(56-20(3)44)32(58-22(5)46)40(17-54-19(2)43)33(59-23(6)47)29(60-34(48)24-11-13-53-15-24)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)57-21(4)45/h10-15,18,27-33,51-52H,16-17H2,1-9H3/t18-,27-,28-,29+,30-,31+,32-,33+,37+,38-,39?,40-,41+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cnccc1[C@@H](C)[C@@](C)(O)C(=O)O[C@@H]([C@H](OC(=O)c1ccoc1)[C@@H]2OC(C)=O)C4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,AVGYGFTXSUAKEM,,,,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 883,6791,-1,,,,0.0,MS1_match,AVGYGFTXSUAKEM-RWRFEADFSA-N,"InChI=1S/C41H47NO20/c1-18-25-10-12-42-14-26(25)35(49)55-16-37(7)27-28(56-20(3)44)32(58-22(5)46)40(17-54-19(2)43)33(59-23(6)47)29(60-34(48)24-11-13-53-15-24)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)57-21(4)45/h10-15,18,27-33,51-52H,16-17H2,1-9H3/t18-,27-,28-,29+,30-,31+,32-,33+,37+,38-,39?,40-,41+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cnccc1[C@@H](C)[C@@](C)(O)C(=O)O[C@@H]([C@H](OC(=O)c1ccoc1)[C@@H]2OC(C)=O)C4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,AVGYGFTXSUAKEM,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 884,6791,-1,,,,0.0,MS1_match,WLAFFGCMQBVKFL-BPAYHVMZSA-N,"InChI=1S/C41H47NO20/c1-18-24-12-13-42-15-25(24)34(48)55-16-37(7)27-28(56-20(3)44)32(59-23(6)47)40(17-54-19(2)43)33(60-35(49)26-11-10-14-53-26)29(57-21(4)45)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)58-22(5)46/h10-15,18,27-33,51-52H,16-17H2,1-9H3/t18-,27+,28-,29+,30-,31-,32+,33+,37+,38-,39-,40+,41-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3[C@H](OC(C)=O)[C@@]14O[C@]3(C)COC(=O)c1cnccc1[C@H](C)[C@](C)(O)C(=O)O[C@@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1ccco1)[C@]4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,WLAFFGCMQBVKFL,,,,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 885,6791,-1,,,,0.0,MS1_match,WLAFFGCMQBVKFL-BPAYHVMZSA-N,"InChI=1S/C41H47NO20/c1-18-24-12-13-42-15-25(24)34(48)55-16-37(7)27-28(56-20(3)44)32(59-23(6)47)40(17-54-19(2)43)33(60-35(49)26-11-10-14-53-26)29(57-21(4)45)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)58-22(5)46/h10-15,18,27-33,51-52H,16-17H2,1-9H3/t18-,27+,28-,29+,30-,31-,32+,33+,37+,38-,39-,40+,41-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3[C@H](OC(C)=O)[C@@]14O[C@]3(C)COC(=O)c1cnccc1[C@H](C)[C@](C)(O)C(=O)O[C@@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1ccco1)[C@]4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,WLAFFGCMQBVKFL,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 886,6791,-1,,,,0.0,MS1_match,JXQXTWWCCNHEQZ-UHFFFAOYSA-N,"InChI=1S/C41H47NO20/c1-18-24-12-13-42-15-25(24)34(48)55-16-37(7)27-28(56-20(3)44)32(58-22(5)46)40(17-54-19(2)43)33(59-23(6)47)29(60-35(49)26-11-10-14-53-26)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)57-21(4)45/h10-15,18,27-33,51-52H,16-17H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cnccc1C(C)C(C)(O)C(=O)OC(C(OC(=O)c1ccco1)C2OC(C)=O)C4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.2691429040001,JXQXTWWCCNHEQZ,,,,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 887,6791,-1,,,,0.0,MS1_match,JXQXTWWCCNHEQZ-UHFFFAOYSA-N,"InChI=1S/C41H47NO20/c1-18-24-12-13-42-15-25(24)34(48)55-16-37(7)27-28(56-20(3)44)32(58-22(5)46)40(17-54-19(2)43)33(59-23(6)47)29(60-35(49)26-11-10-14-53-26)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)57-21(4)45/h10-15,18,27-33,51-52H,16-17H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cnccc1C(C)C(C)(O)C(=O)OC(C(OC(=O)c1ccco1)C2OC(C)=O)C4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.2691429040001,JXQXTWWCCNHEQZ,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 888,6791,-1,,,,0.0,MS1_match,ZWMDSFIGEYLEIP-PEWXIWONSA-N,"InChI=1S/C41H47NO20/c1-18-24-12-13-42-15-25(24)34(48)54-16-37(7)27-28(56-19(2)43)32(59-22(5)46)40(17-55-35(49)26-11-10-14-53-26)33(60-23(6)47)29(57-20(3)44)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)58-21(4)45/h10-15,18,27-33,51-52H,16-17H2,1-9H3/t18?,27-,28-,29+,30-,31+,32-,33+,37+,38?,39+,40-,41+/m1/s1",CC(=O)O[C@@H]1[C@@H]2[C@@H](OC(C)=O)[C@@]34O[C@@]2(C)COC(=O)c2cnccc2C(C)C(C)(O)C(=O)O[C@@H]([C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(COC(=O)c2ccco2)[C@@H]1OC(C)=O)[C@]4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.2691429040001,ZWMDSFIGEYLEIP,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 889,6791,-1,,,,0.0,MS1_match,BGZMJSHSQVGXTE-MIFXYLFUSA-N,"InChI=1S/C41H47NO20/c1-19(43)54-18-40-32(58-22(4)46)28(56-20(2)44)27-30(57-21(3)45)41(40)39(8,52)31(29(33(40)59-23(5)47)60-35(49)26-12-10-16-53-26)61-36(50)37(6,51)14-13-25-24(11-9-15-42-25)34(48)55-17-38(27,7)62-41/h9-12,15-16,27-33,51-52H,13-14,17-18H2,1-8H3/t27-,28-,29+,30-,31+,32-,33+,37?,38+,39+,40-,41+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1CCC(C)(O)C(=O)O[C@@H]([C@H](OC(=O)c1ccco1)[C@@H]2OC(C)=O)[C@]4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,BGZMJSHSQVGXTE,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 890,6791,-1,,,,0.0,MS1_match,SNHDYNFTVFWAHX-KTIRQYCASA-N,"InChI=1S/C41H47NO20/c1-18-25-10-12-42-14-26(25)35(49)54-16-37(7)27-28(56-19(2)43)32(59-22(5)46)40(17-55-34(48)24-11-13-53-15-24)33(60-23(6)47)29(57-20(3)44)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)58-21(4)45/h10-15,18,27-33,51-52H,16-17H2,1-9H3/t18-,27+,28+,29+,30-,31-,32+,33+,37+,38-,39+,40+,41-/m1/s1",CC(=O)O[C@H]1[C@H]2[C@@H](OC(C)=O)[C@]34O[C@@]2(C)COC(=O)c2cnccc2[C@@H](C)[C@@](C)(O)C(=O)O[C@H]([C@H](OC(C)=O)[C@H](OC(C)=O)[C@]3(COC(=O)c2ccoc2)[C@H]1OC(C)=O)[C@]4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,SNHDYNFTVFWAHX,,,,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 891,6791,-1,,,,0.0,MS1_match,SNHDYNFTVFWAHX-RWRFEADFSA-N,"InChI=1S/C41H47NO20/c1-18-25-10-12-42-14-26(25)35(49)54-16-37(7)27-28(56-19(2)43)32(59-22(5)46)40(17-55-34(48)24-11-13-53-15-24)33(60-23(6)47)29(57-20(3)44)31(61-36(50)38(18,8)51)39(9,52)41(40,62-37)30(27)58-21(4)45/h10-15,18,27-33,51-52H,16-17H2,1-9H3/t18-,27-,28-,29+,30-,31+,32-,33+,37+,38-,39?,40-,41+/m1/s1",CC(=O)O[C@@H]1[C@@H]2[C@@H](OC(C)=O)[C@@]34O[C@@]2(C)COC(=O)c2cnccc2[C@@H](C)[C@@](C)(O)C(=O)O[C@@H]([C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(COC(=O)c2ccoc2)[C@@H]1OC(C)=O)C4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,SNHDYNFTVFWAHX,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 892,6791,-1,,,,0.0,MS1_match,JOKOHWLSQAZHFX-MBJREJSGSA-N,"InChI=1S/C41H47NO20/c1-19(43)54-18-40-32(58-22(4)46)28(56-20(2)44)27-30(57-21(3)45)41(40)39(8,52)31(29(33(40)59-23(5)47)60-34(48)24-12-15-53-16-24)61-36(50)37(6,51)13-11-26-25(10-9-14-42-26)35(49)55-17-38(27,7)62-41/h9-10,12,14-16,27-33,51-52H,11,13,17-18H2,1-8H3/t27-,28?,29?,30?,31-,32?,33?,37-,38+,39+,40-,41+/m1/s1",CC(=O)OC[C@]12C(OC(C)=O)C(OC(C)=O)[C@@H]3C(OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1CC[C@@](C)(O)C(=O)O[C@H](C(OC(=O)c1ccoc1)C2OC(C)=O)[C@]4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,JOKOHWLSQAZHFX,,,,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 893,6791,-1,,,,0.0,MS1_match,JOKOHWLSQAZHFX-MBJREJSGSA-N,"InChI=1S/C41H47NO20/c1-19(43)54-18-40-32(58-22(4)46)28(56-20(2)44)27-30(57-21(3)45)41(40)39(8,52)31(29(33(40)59-23(5)47)60-34(48)24-12-15-53-16-24)61-36(50)37(6,51)13-11-26-25(10-9-14-42-26)35(49)55-17-38(27,7)62-41/h9-10,12,14-16,27-33,51-52H,11,13,17-18H2,1-8H3/t27-,28?,29?,30?,31-,32?,33?,37-,38+,39+,40-,41+/m1/s1",CC(=O)OC[C@]12C(OC(C)=O)C(OC(C)=O)[C@@H]3C(OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1CC[C@@](C)(O)C(=O)O[C@H](C(OC(=O)c1ccoc1)C2OC(C)=O)[C@]4(C)O,C41H47NO20,pos_2_2proton3acetonitrile,873.269142904,JOKOHWLSQAZHFX,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 894,6791,-1,,,,0.0,MS1_match,UATKLEJGJXQCCG-CLYWGZERSA-N,"InChI=1S/C23H30O12/c1-23(30)8-13(25)11-5-6-32-21(16(11)23)35-22-19(28)18(27)17(26)15(34-22)9-33-20(29)10-3-4-12(24)14(7-10)31-2/h3-7,11,13,15-19,21-22,24-28,30H,8-9H2,1-2H3/t11-,13+,15+,16+,17+,18-,19+,21-,22-,23-/m0/s1",COc1cc(C(=O)OC[C@H]2O[C@@H](O[C@@H]3OC=C[C@@H]4[C@H]3[C@@](C)(O)C[C@H]4O)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O,C23H30O12,pos_1_1proton,498.1737264,UATKLEJGJXQCCG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,0,6.0 895,6791,-1,,,,0.0,MS1_match,PJAISAAYEQAVGA-YYFWYDPZSA-N,"InChI=1S/C23H30O12/c1-23(30)8-14(33-20(29)10-3-4-12(25)13(7-10)31-2)11-5-6-32-21(16(11)23)35-22-19(28)18(27)17(26)15(9-24)34-22/h3-7,11,14-19,21-22,24-28,30H,8-9H2,1-2H3/t11-,14+,15+,16+,17+,18-,19+,21-,22-,23-/m0/s1",COc1cc(C(=O)O[C@@H]2C[C@](C)(O)[C@H]3[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C[C@H]32)ccc1O,C23H30O12,pos_1_1proton,498.1737263999998,PJAISAAYEQAVGA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,0,6.0 896,6791,-1,,,,0.0,MS1_match,PJAISAAYEQAVGA-YYFWYDPZSA-N,"InChI=1S/C23H30O12/c1-23(30)8-14(33-20(29)10-3-4-12(25)13(7-10)31-2)11-5-6-32-21(16(11)23)35-22-19(28)18(27)17(26)15(9-24)34-22/h3-7,11,14-19,21-22,24-28,30H,8-9H2,1-2H3/t11-,14+,15+,16+,17+,18-,19+,21-,22-,23-/m0/s1",COc1cc(C(=O)O[C@@H]2C[C@](C)(O)[C@H]3[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C[C@H]32)ccc1O,C23H30O12,pos_1_1proton,498.1737263999998,PJAISAAYEQAVGA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,0,6.0 897,6791,-1,,,,0.0,MS1_match,ZCWPTLWVODLXTA-PLVBNVFYSA-N,"InChI=1S/C43H50N2O20/c1-20(46)57-19-42-34(61-23(4)49)30(59-21(2)47)29-32(60-22(3)48)43(42)41(8,56)33(31(35(42)62-24(5)50)63-36(52)25-12-13-28(51)45(9)17-25)64-38(54)39(6,55)15-14-27-26(11-10-16-44-27)37(53)58-18-40(29,7)65-43/h10-13,16-17,29-35,55-56H,14-15,18-19H2,1-9H3/t29-,30-,31+,32-,33+,34-,35+,39+,40+,41+,42-,43+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1CC[C@](C)(O)C(=O)O[C@@H]([C@H](OC(=O)c1ccc(=O)n(C)c1)[C@@H]2OC(C)=O)[C@]4(C)O,C43H50N2O20,pos_2_2proton2acetonitrile,914.295692,ZCWPTLWVODLXTA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 898,6791,-1,,,,0.0,MS1_match,ZCWPTLWVODLXTA-UHFFFAOYSA-N,"InChI=1S/C43H50N2O20/c1-20(46)57-19-42-34(61-23(4)49)30(59-21(2)47)29-32(60-22(3)48)43(42)41(8,56)33(31(35(42)62-24(5)50)63-36(52)25-12-13-28(51)45(9)17-25)64-38(54)39(6,55)15-14-27-26(11-10-16-44-27)37(53)58-18-40(29,7)65-43/h10-13,16-17,29-35,55-56H,14-15,18-19H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)(O)C(=O)OC(C(OC(=O)c1ccc(=O)n(C)c1)C2OC(C)=O)C4(C)O,C43H50N2O20,pos_2_2proton2acetonitrile,914.295692,ZCWPTLWVODLXTA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Gymnosporia emarginata,35854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia inermis'],6,0,6.0 899,6790,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7665998,ISDB,HXQHFNIKBKZGRP-UHFFFAOYSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)",CCCCCC=CCC=CCCC=CCCCC(=O)O,C18H30O2,,278.2245802,HXQHFNIKBKZGRP,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Teucrium cubense,3882648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Teucrium'],['Teucrium cubense'],4,3,8.566399097442627 900,6790,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7665998,ISDB,HXQHFNIKBKZGRP-UHFFFAOYSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)",CCCCCC=CCC=CCCC=CCCCC(=O)O,C18H30O2,,278.2245802,HXQHFNIKBKZGRP,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Teucrium depressum,3882648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Teucrium'],['Teucrium cubense'],4,3,8.566399097442627 901,6785,-1,,,,0.0,MS1_match,OHJWWOZXCKEOGK-LZIBPDADSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.513336352,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,0,7.0 902,6785,-1,,,,0.0,MS1_match,OHJWWOZXCKEOGK-YDOLDEOXSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.5133363520001,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 903,6785,-1,,,,0.0,MS1_match,OHJWWOZXCKEOGK-LZIBPDADSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.513336352,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,0,7.0 904,6785,-1,,,,0.0,MS1_match,OHJWWOZXCKEOGK-YDOLDEOXSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.5133363520001,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 905,6785,-1,,,,0.0,MS1_match,FYSAXYBPXKLMJO-IFECXJOTSA-N,"InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.5133363520004,FYSAXYBPXKLMJO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,0,7.0 906,6785,-1,,,,0.0,MS1_match,FYSAXYBPXKLMJO-IFECXJOTSA-N,"InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.5133363520004,FYSAXYBPXKLMJO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 907,6785,-1,,,,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone multifida,896056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone multifida'],7,0,7.0 908,6785,-1,,,,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone narcissiflora,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,0,7.0 909,6785,-1,,,,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton1ammonium,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum narcissiflorum,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,0,7.0 910,6785,-1,,,,0.0,MS1_match,ACFQHDXOOYLTCN-JPPKDPIWSA-N,"InChI=1S/C47H76O16/c1-21(2)23-11-16-47(42(56)57)18-17-45(7)24(30(23)47)9-10-28-44(6)14-13-29(43(4,5)27(44)12-15-46(28,45)8)61-41-38(32(51)25(49)20-58-41)63-40-36(55)37(31(50)22(3)59-40)62-39-35(54)34(53)33(52)26(19-48)60-39/h22-41,48-55H,1,9-20H2,2-8H3,(H,56,57)/t22-,23-,24+,25-,26+,27-,28+,29-,30+,31-,32-,33+,34-,35+,36+,37+,38+,39-,40-,41-,44-,45+,46+,47-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C47H76O16,pos_1_1proton1ammonium,896.5133363520001,ACFQHDXOOYLTCN,Terpenoids,Triterpenoids,Lupane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 911,6785,-1,,,,0.0,MS1_match,WOOPUJXMROOOPP-KSYIBZFCSA-N,"InChI=1S/C47H76O16/c1-21(2)23-11-16-47(42(56)57)18-17-45(7)24(30(23)47)9-10-28-44(6)14-13-29(43(4,5)27(44)12-15-46(28,45)8)62-41-38(63-39-36(54)34(52)31(49)22(3)59-39)33(51)26(20-58-41)61-40-37(55)35(53)32(50)25(19-48)60-40/h22-41,48-55H,1,9-20H2,2-8H3,(H,56,57)/t22-,23-,24+,25+,26-,27-,28+,29-,30+,31-,32+,33-,34+,35-,36+,37+,38+,39-,40-,41-,44-,45+,46+,47-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C47H76O16,pos_1_1proton1ammonium,896.5133363520004,WOOPUJXMROOOPP,Terpenoids,Triterpenoids,Lupane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 912,6782,-1,,,,0.26445705,ISDB,,,,,,,ZBPHOPAOHAJOMC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0578281879425049 913,6781,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.21363524,ISDB,RYRBXTWVSOVEQI-XKDJXWPVSA-N,"InChI=1S/C55H88O24/c1-22(2)24-11-16-55(50(70)79-48-41(66)36(61)34(59)28(75-48)21-72-46-43(68)38(63)44(26(19-56)73-46)77-49-42(67)37(62)39(64)45(69)78-49)18-17-53(7)25(32(24)55)9-10-30-52(6)14-13-31(51(4,5)29(52)12-15-54(30,53)8)76-47-40(65)35(60)33(58)27(74-47)20-71-23(3)57/h24-49,56,58-69H,1,9-21H2,2-8H3/t24-,25+,26+,27+,28+,29-,30+,31-,32+,33+,34+,35-,36-,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47-,48-,49+,52-,53+,54+,55-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@@H](O)[C@H](O)[C@@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C55H88O24,,1132.5665536960005,RYRBXTWVSOVEQI,Terpenoids,Triterpenoids,Lupane triterpenoids,Schefflera actinophylla,1064021.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Schefflera'],['Schefflera actinophylla'],4,2,5.854540944099426 914,6777,-1,,,,0.0,MS1_match,XXZPXRQPWFAXCK-WQFMGJDKSA-N,"InChI=1S/C17H26O5/c1-10(2)7-15(19)22-17-16-11(3)5-6-14(16)13(9-21-17)8-20-12(4)18/h9-11,14,16-17H,5-8H2,1-4H3/t11-,14+,16+,17-/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1CC[C@@H]2C,C17H26O5,pos_2MNa,310.178023932,XXZPXRQPWFAXCK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 915,6769,554,Terpenoids,Sesquiterpenoids,,0.20989333,ISDB,QBTBRUNHKDMUKA-WYSXDBPOSA-N,"InChI=1S/C23H42O9/c1-13(7-6-9-23(4,5)28)8-10-29-22-20(27)19(26)18(25)17(32-22)12-30-21-15(3)14(2)16(11-24)31-21/h8,14-22,24-28H,6-7,9-12H2,1-5H3/b13-8+/t14-,15-,16+,17-,18-,19+,20-,21-,22-/m1/s1",C/C(=C\CO[C@@H]1O[C@H](CO[C@@H]2O[C@@H](CO)[C@H](C)[C@H]2C)[C@@H](O)[C@H](O)[C@H]1O)CCCC(C)(C)O,C23H42O9,,462.282882924,QBTBRUNHKDMUKA,Terpenoids,Sesquiterpenoids,,Rodgersia sambucifolia,44468.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Saxifragaceae'],['Unknown'],['Rodgersia'],['Rodgersia sambucifolia'],4,2,5.839573323726654 916,6768,531,Fatty acids,Fatty acyls,Hydrocarbons,0.20516825,ISDB,,,,,,,FUOXNICVOQDEMR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8206729888916016 917,6763,-1,,,,0.0,MS1_match,SGNBVLSWZMBQTH-PODYLUTMSA-N,"InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20-,22+,23+,24-,25+,26+,27+,28-/m1/s1",CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H48O,pos_1_1sodium1acetonitrile,400.370516156,SGNBVLSWZMBQTH,Terpenoids,Steroids,Cholestane steroids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 918,6763,-1,,,,0.0,MS1_match,SGNBVLSWZMBQTH-AUZDMFNXSA-N,"InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20+,22?,23-,24+,25-,26-,27-,28+/m0/s1",CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H48O,pos_1_1sodium1acetonitrile,400.370516156,SGNBVLSWZMBQTH,Terpenoids,Steroids,Cholestane steroids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 919,6763,-1,,,,0.0,MS1_match,SGNBVLSWZMBQTH-PODYLUTMSA-N,"InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20-,22+,23+,24-,25+,26+,27+,28-/m1/s1",CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H48O,pos_1_1sodium1acetonitrile,400.370516156,SGNBVLSWZMBQTH,Terpenoids,Steroids,Cholestane steroids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 920,6763,-1,,,,0.0,MS1_match,SGNBVLSWZMBQTH-AUZDMFNXSA-N,"InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20+,22?,23-,24+,25-,26-,27-,28+/m0/s1",CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H48O,pos_1_1sodium1acetonitrile,400.370516156,SGNBVLSWZMBQTH,Terpenoids,Steroids,Cholestane steroids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 921,6763,-1,,,,0.0,MS1_match,LMYZQUNLYGJIHI-SPONXPENSA-N,"InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h10,18-20,22-26,29H,7-9,11-17H2,1-6H3/t19-,20+,22-,23+,24+,25+,26+,27-,28+/m1/s1",CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4[C@H](C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H48O,pos_1_1sodium1acetonitrile,400.3705161559999,LMYZQUNLYGJIHI,Terpenoids,Steroids,Cholestane steroids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 922,6761,210,Fatty acids,Glycerolipids,Apocarotenoids (Ψ-),0.21471812,ISDB,ZXEPHOYZDSLBJV-UHFFFAOYSA-N,"InChI=1S/C32H42O/c1-27(2)15-10-18-30(5)21-13-23-31(6)22-11-19-28(3)16-8-9-17-29(4)20-12-24-32(7)25-14-26-33/h8-9,11-17,19-26H,10,18H2,1-7H3",CC(C)=CCCC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=O,C32H42O,,442.323565964,ZXEPHOYZDSLBJV,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,3,6.358872473239899 923,6760,1344,,,,0.2830836,ISDB,,,,,,,QRRBJZIHSLBXNV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1323343515396118 924,6758,97,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.22541216,ISDB,,,,,,,QPHICNLPZQPLCU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9016486406326294 925,6755,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.30036274,ISDB,,,,,,,WPRKWPORZTWCSR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2014509439468384 926,6752,80,Terpenoids,Steroids,Spirostane steroids,0.42012137,ISDB,QDJYUSAVAQTFPO-LCYMEKLSSA-N,"InChI=1S/C33H56O9/c1-16(2)6-9-23(36)17(3)27-24(41-31-30(40)29(39)28(38)25(15-34)42-31)14-22-20-8-7-18-12-19(35)13-26(37)33(18,5)21(20)10-11-32(22,27)4/h7,16-17,19-31,34-40H,6,8-15H2,1-5H3/t17-,19?,20-,21+,22+,23?,24?,25-,26?,27+,28+,29+,30-,31-,32+,33+/m1/s1",CC(C)CCC(O)[C@@H](C)[C@H]1C(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C[C@H]2[C@@H]3CC=C4CC(O)CC(O)[C@]4(C)[C@H]3CC[C@]12C,C33H56O9,,596.392433372,QDJYUSAVAQTFPO,Terpenoids,Steroids,Cholestane steroids,Allium stipitatum,942173.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium stipitatum'],4,2,6.680485486984253 927,6752,80,Terpenoids,Steroids,Spirostane steroids,0.42012137,ISDB,QDJYUSAVAQTFPO-LCYMEKLSSA-N,"InChI=1S/C33H56O9/c1-16(2)6-9-23(36)17(3)27-24(41-31-30(40)29(39)28(38)25(15-34)42-31)14-22-20-8-7-18-12-19(35)13-26(37)33(18,5)21(20)10-11-32(22,27)4/h7,16-17,19-31,34-40H,6,8-15H2,1-5H3/t17-,19?,20-,21+,22+,23?,24?,25-,26?,27+,28+,29+,30-,31-,32+,33+/m1/s1",CC(C)CCC(O)[C@@H](C)[C@H]1C(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C[C@H]2[C@@H]3CC=C4CC(O)CC(O)[C@]4(C)[C@H]3CC[C@]12C,C33H56O9,,596.392433372,QDJYUSAVAQTFPO,Terpenoids,Steroids,Cholestane steroids,Allium suworowii,989424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium suworowii'],4,2,6.680485486984253 928,6750,-1,,,,0.0,MS1_match,DYFUVQSGLMQLRX-ALBXZGMBSA-N,"InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O10,pos_1_sodium,648.387347992,DYFUVQSGLMQLRX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,0,7.0 929,6750,-1,,,,0.0,MS1_match,DYFUVQSGLMQLRX-ALBXZGMBSA-N,"InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O10,pos_1_sodium,648.387347992,DYFUVQSGLMQLRX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,0,7.0 930,6747,80,Terpenoids,Steroids,Spirostane steroids,0.55720997,ISDB,ICEAAFSBLFFHMH-USZBQAPISA-N,"InChI=1S/C35H56O12/c1-16-6-9-35(43-15-16)17(2)27-22(47-35)11-21-19-10-26(38)34(42)13-24(44-18(3)37)23(12-33(34,5)20(19)7-8-32(21,27)4)45-31-30(41)29(40)28(39)25(14-36)46-31/h16-17,19-31,36,38-42H,6-15H2,1-5H3/t16-,17+,19-,20+,21+,22+,23-,24-,25-,26-,27+,28-,29+,30-,31-,32+,33-,34+,35-/m1/s1",CC(=O)O[C@@H]1C[C@]2(O)[C@H](O)C[C@H]3[C@@H]4C[C@@H]5O[C@]6(CC[C@@H](C)CO6)[C@@H](C)[C@@H]5[C@@]4(C)CC[C@@H]3[C@@]2(C)C[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C35H56O12,,668.377177232,ICEAAFSBLFFHMH,Terpenoids,Steroids,Spirostane steroids,Allium giganteum,416484.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium giganteum'],4,3,7.728839874267578 931,6747,80,Terpenoids,Steroids,Spirostane steroids,0.55720997,ISDB,ICEAAFSBLFFHMH-USZBQAPISA-N,"InChI=1S/C35H56O12/c1-16-6-9-35(43-15-16)17(2)27-22(47-35)11-21-19-10-26(38)34(42)13-24(44-18(3)37)23(12-33(34,5)20(19)7-8-32(21,27)4)45-31-30(41)29(40)28(39)25(14-36)46-31/h16-17,19-31,36,38-42H,6-15H2,1-5H3/t16-,17+,19-,20+,21+,22+,23-,24-,25-,26-,27+,28-,29+,30-,31-,32+,33-,34+,35-/m1/s1",CC(=O)O[C@@H]1C[C@]2(O)[C@H](O)C[C@H]3[C@@H]4C[C@@H]5O[C@]6(CC[C@@H](C)CO6)[C@@H](C)[C@@H]5[C@@]4(C)CC[C@@H]3[C@@]2(C)C[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C35H56O12,,668.377177232,ICEAAFSBLFFHMH,Terpenoids,Steroids,Spirostane steroids,Allium karataviense,942185.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium karataviense'],4,3,7.728839874267578 932,6744,210,Fatty acids,Glycerolipids,Apocarotenoids (Ψ-),0.26188928,ISDB,,,,,,,KBERLNPFENTXOE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0475571155548096 933,6743,-1,,,,0.4138967,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,0,7.655586838722229 934,6743,-1,,,,0.4138967,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,7.655586838722229 935,6743,-1,,,,0.4138967,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,7.655586838722229 936,6741,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.58026403,ISDB,SAHCQBPGXQFTRA-UHFFFAOYSA-N,"InChI=1S/C27H49O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(29)37-18-20(28)19-38-40(35,36)39-27-25(33)23(31)22(30)24(32)26(27)34/h6-7,9-10,20,22-28,30-34H,2-5,8,11-19H2,1H3,(H,35,36)",CCCCCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O,C27H49O12P,,596.2961636379998,SAHCQBPGXQFTRA,Fatty acids,Glycerophospholipids,Glycerophosphoinositols,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,6.321056127548218 937,6740,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,HPJJCRNQEWRFQW-ILXVDBEPSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(14(22)9-18)27-15(23)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-22,25H,2,8-9H2,1H3/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H](O)C1,C18H22O9,pos_1_sodium,382.126382284,HPJJCRNQEWRFQW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 938,6740,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,CPYDMLXRLHYXSV-UNKAVFLYSA-N,"InChI=1S/C18H22O9/c1-25-13-7-10(3-5-11(13)19)4-6-15(21)27-14-9-18(24,17(23)26-2)8-12(20)16(14)22/h3-7,12,14,16,19-20,22,24H,8-9H2,1-2H3/b6-4+/t12-,14-,16-,18+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(OC)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_sodium,382.126382284,CPYDMLXRLHYXSV,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 939,6740,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_sodium,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 940,6740,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_sodium,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 941,6736,45,Fatty acids,Fatty Acids and Conjugates,,0.0,MS1_match,RKMQRPYLPSKVNS-UHFFFAOYSA-N,"InChI=1S/C6H10O4/c1-10-6(9)3-2-5(8)4-7/h7H,2-4H2,1H3",COC(=O)CCC(=O)CO,C6H10O4,pos_1_1proton1acetonitrile,146.0579088,RKMQRPYLPSKVNS,Fatty acids,Fatty Acids and Conjugates,,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,2,9.0 942,6735,446,Polyketides,Steroids,Stigmastane steroids,0.2049054,ISDB,QJPFBEKUNZRFKX-JJBABQCSSA-N,"InChI=1S/C38H50O5/c1-23(2)14-16-28(26(7)8)21-37-22-29(17-15-24(3)4)36(9,10)38(35(37)43,19-18-25(5)6)34(42)31(33(37)41)32(40)27-12-11-13-30(39)20-27/h11-14,20,28-29,39-40H,3,5,7,15-19,21-22H2,1-2,4,6,8-10H3/t28-,29+,37+,38-/m0/s1",C=C(C)CC[C@@H]1C[C@]2(C[C@H](CC=C(C)C)C(=C)C)C(=O)C(=C(O)c3cccc(O)c3)C(=O)[C@@](CCC(=C)C)(C2=O)C1(C)C,C38H50O5,,586.3658247,QJPFBEKUNZRFKX,Polyketides,Meroterpenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),Moronobea coccinea,373208.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Symphonieae'],['Moronobea'],['Moronobea coccinea'],4,1,5.3196216225624084 943,6733,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.24192819,ISDB,UAUUFLADFXKYAU-UHFFFAOYSA-N,"InChI=1S/C36H58O8/c1-20-27(40)28(41)29(42)30(43-20)44-26-11-12-32(4)23(33(26,5)18-37)10-13-34(6)24(32)9-8-21-22-16-31(2,3)14-15-36(22,19-38)25(39)17-35(21,34)7/h8-9,20,23-30,37-42H,10-19H2,1-7H3",CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC3=C5CC(C)(C)CCC5(CO)C(O)CC34C)C2(C)CO)C(O)C(O)C1O,C36H58O8,,618.413168816,UAUUFLADFXKYAU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum smithii var. parvifolium,657161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum smithii'],4,3,6.467712759971619 944,6733,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.24192819,ISDB,UAUUFLADFXKYAU-AKICHWIXSA-N,"InChI=1S/C36H58O8/c1-20-27(40)28(41)29(42)30(43-20)44-26-11-12-32(4)23(33(26,5)18-37)10-13-34(6)24(32)9-8-21-22-16-31(2,3)14-15-36(22,19-38)25(39)17-35(21,34)7/h8-9,20,23-30,37-42H,10-19H2,1-7H3/t20-,23-,24-,25+,26+,27+,28+,29-,30+,32+,33+,34-,35-,36-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O)[C@H]1O,C36H58O8,,618.413168816,UAUUFLADFXKYAU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum smithii,820033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum smithii'],4,3,6.467712759971619 945,6733,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.24192819,ISDB,UAUUFLADFXKYAU-WQPKRVEVSA-N,"InChI=1S/C36H58O8/c1-20-27(40)28(41)29(42)30(43-20)44-26-11-12-32(4)23(33(26,5)18-37)10-13-34(6)24(32)9-8-21-22-16-31(2,3)14-15-36(22,19-38)25(39)17-35(21,34)7/h8-9,20,23-30,37-42H,10-19H2,1-7H3/t20-,23-,24-,25-,26+,27+,28+,29-,30+,32+,33+,34-,35-,36-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O)[C@H]1O,C36H58O8,,618.413168816,UAUUFLADFXKYAU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum chinense,486734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum chinense'],4,3,6.467712759971619 946,6731,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2650648,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,9.560259222984314 947,6731,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2650648,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,9.560259222984314 948,6728,80,Terpenoids,Steroids,Spirostane steroids,0.40324998,ISDB,RXJRCRXMTRIYTO-HOTIZTCWSA-N,"InChI=1S/C35H58O10/c1-29(2)18-8-9-19-32(6)27(41)25(40)26(31(5)12-10-22(45-31)30(3,4)42)33(32,7)20(37)14-35(19)16-34(18,35)13-11-21(29)44-28-24(39)23(38)17(36)15-43-28/h17-28,36-42H,8-16H2,1-7H3/t17-,18+,19+,20+,21+,22+,23+,24-,25-,26-,27+,28+,31-,32-,33-,34-,35+/m1/s1",CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)[C@H](O)[C@@]3(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46C[C@H](O)[C@]23C)O1,C35H58O10,,638.402998056,RXJRCRXMTRIYTO,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,1,8.11299991607666 949,6727,-1,,,,0.0,MS1_match,IGODOXYLBBXFDW-NSHDSACASA-N,"InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3/t11-/m0/s1",CC(=O)OC(C)(C)[C@H]1CC=C(C)CC1,C12H20O2,pos_2MH,196.14632988,IGODOXYLBBXFDW,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 950,6727,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-UHFFFAOYSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3",CC(=O)OC1CC2CCC1(C)C2(C)C,C12H20O2,pos_2MH,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 951,6727,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-UHFFFAOYSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3",CC(=O)OC1CC2CCC1(C)C2(C)C,C12H20O2,pos_2MH,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana celtica,21455.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana celtica'],6,0,6.0 952,6727,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-HOSYDEDBSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1",CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C12H20O2,pos_2MH,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 953,6727,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-HOSYDEDBSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1",CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C12H20O2,pos_2MH,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana hardwickii,139324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana hardwickii'],6,0,6.0 954,6727,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-HOSYDEDBSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1",CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C12H20O2,pos_2MH,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana moonii,139324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana hardwickii'],6,0,6.0 955,6721,637,Carbohydrates,Monoterpenoids,Iridoids monoterpenoids,0.24544212,ISDB,,,,,,,QFVKRCNWCDNNRR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9817684888839722 956,6720,80,Terpenoids,Steroids,Spirostane steroids,0.4351807,ISDB,IATIAUOAJIFOSI-XVTUODIHSA-N,"InChI=1S/C39H64O13/c1-18-9-12-39(47-17-18)19(2)28-24-8-7-22-23(38(24,4)14-25(28)52-39)6-5-20-13-21(10-11-37(20,22)3)48-36-34(32(45)30(43)27(16-41)50-36)51-35-33(46)31(44)29(42)26(15-40)49-35/h18-36,40-46H,5-17H2,1-4H3/t18-,19-,20-,21-,22-,23+,24+,25-,26+,27+,28-,29-,30-,31-,32-,33+,34+,35-,36+,37-,38-,39+/m0/s1",C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@]3(C)[C@H](CC[C@H]4[C@H]3CC[C@H]3C[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]34C)[C@@H]1[C@@H]2C,C39H64O13,,740.434692108,IATIAUOAJIFOSI,Terpenoids,Steroids,Spirostane steroids,Asparagus officinalis,748359.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Asparagus'],['Asparagus officinalis'],4,3,7.2407227754592896 957,6720,80,Terpenoids,Steroids,Spirostane steroids,0.4351807,ISDB,IATIAUOAJIFOSI-UHFFFAOYSA-N,"InChI=1S/C39H64O13/c1-18-9-12-39(47-17-18)19(2)28-24-8-7-22-23(38(24,4)14-25(28)52-39)6-5-20-13-21(10-11-37(20,22)3)48-36-34(32(45)30(43)27(16-41)50-36)51-35-33(46)31(44)29(42)26(15-40)49-35/h18-36,40-46H,5-17H2,1-4H3",CC1CCC2(OC1)OC1CC3(C)C(CCC4C3CCC3CC(OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)CCC34C)C1C2C,C39H64O13,,740.434692108,IATIAUOAJIFOSI,Terpenoids,Steroids,Spirostane steroids,Asparagus oligoclonos,200961.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Asparagus'],['Asparagus oligoclonos'],4,3,7.2407227754592896 958,6720,80,Terpenoids,Steroids,Spirostane steroids,0.4351807,ISDB,IATIAUOAJIFOSI-XVTUODIHSA-N,"InChI=1S/C39H64O13/c1-18-9-12-39(47-17-18)19(2)28-24-8-7-22-23(38(24,4)14-25(28)52-39)6-5-20-13-21(10-11-37(20,22)3)48-36-34(32(45)30(43)27(16-41)50-36)51-35-33(46)31(44)29(42)26(15-40)49-35/h18-36,40-46H,5-17H2,1-4H3/t18-,19-,20-,21-,22-,23+,24+,25-,26+,27+,28-,29-,30-,31-,32-,33+,34+,35-,36+,37-,38-,39+/m0/s1",C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@]3(C)[C@H](CC[C@H]4[C@H]3CC[C@H]3C[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]34C)[C@@H]1[C@@H]2C,C39H64O13,,740.434692108,IATIAUOAJIFOSI,Terpenoids,Steroids,Spirostane steroids,Asparagus racemosus,724323.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Asparagus'],['Asparagus racemosus'],4,3,7.2407227754592896 959,6719,210,Fatty acids,Glycerolipids,Apocarotenoids (Ψ-),0.27432778,ISDB,NIYVBTJLTZSNNA-OAQYLSRUSA-N,"InChI=1S/C23H44O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21(28-20(2)26)17-23(27)29-22(18-24)19-25/h21-22,24-25H,3-19H2,1-2H3/t21-/m1/s1",CCCCCCCCCCCCCCC[C@H](CC(=O)OC(CO)CO)OC(C)=O,C23H44O6,,416.313789128,NIYVBTJLTZSNNA,Fatty acids,Glycerolipids,Monoacylglycerols,Paulownia tomentosa,305916.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Paulowniaceae'],['Unknown'],['Paulownia'],['Paulownia tomentosa'],4,2,6.0973111391067505 960,6718,-1,,,,0.8607143,ISDB,LRYANVPYFCKCCR-UHFFFAOYSA-N,"InChI=1S/C14H12O4/c15-11-6-7-13(16)12(8-11)14(17)18-9-10-4-2-1-3-5-10/h1-8,15-16H,9H2",O=C(OCc1ccccc1)c1cc(O)ccc1O,C14H12O4,,244.073558864,LRYANVPYFCKCCR,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Populus balsamifera,374288.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Saliceae'],['Populus'],['Populus balsamifera'],4,0,7.442857265472412 961,6718,-1,,,,0.8607143,ISDB,LRYANVPYFCKCCR-UHFFFAOYSA-N,"InChI=1S/C14H12O4/c15-11-6-7-13(16)12(8-11)14(17)18-9-10-4-2-1-3-5-10/h1-8,15-16H,9H2",O=C(OCc1ccccc1)c1cc(O)ccc1O,C14H12O4,,244.073558864,LRYANVPYFCKCCR,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Populus candicans,5763646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Saliceae'],['Populus'],['Populus candicans'],4,0,7.442857265472412 962,6717,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,AXCXHFKZHDEKTP-UHFFFAOYSA-N,"InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3",COc1ccc(C=CC=O)cc1,C10H10O2,pos_1_1proton,162.06807956,AXCXHFKZHDEKTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,1,6.5 963,6716,80,Terpenoids,Steroids,Spirostane steroids,0.46110973,ISDB,ZASVHPQOIKNCFH-WKXZVYSISA-N,"InChI=1S/C37H62O12/c1-18(2)6-9-25(39)19(3)37(45)28(48-34-31(44)32(27(41)17-47-34)49-33-30(43)29(42)26(40)16-46-33)15-24-22-8-7-20-14-21(38)10-12-35(20,4)23(22)11-13-36(24,37)5/h7,18-19,21-34,38-45H,6,8-17H2,1-5H3/t19-,21+,22-,23+,24+,25?,26-,27+,28+,29+,30-,31-,32+,33+,34+,35+,36+,37-/m1/s1",CC(C)CCC(O)[C@@H](C)[C@@]1(O)[C@@H](O[C@@H]2OC[C@H](O)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C,C37H62O12,,698.424127424,ZASVHPQOIKNCFH,Terpenoids,Steroids,Cholestane steroids,Ornithogalum saundersiae,815304.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hyacinthaceae'],['Unknown'],['Ornithogalum'],['Ornithogalum saundersiae'],4,2,6.844438910484314 964,6713,210,Fatty acids,Glycerolipids,Apocarotenoids (Ψ-),0.2909285,ISDB,AQBROBGRFDFAQQ-HSZRJFAPSA-N,"InChI=1S/C25H48O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(30-22(2)28)19-25(29)31-24(20-26)21-27/h23-24,26-27H,3-21H2,1-2H3/t23-/m1/s1",CCCCCCCCCCCCCCCCC[C@H](CC(=O)OC(CO)CO)OC(C)=O,C25H48O6,,444.345089256,AQBROBGRFDFAQQ,Fatty acids,Glycerolipids,Diacylglycerols,Paulownia tomentosa,305916.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Paulowniaceae'],['Unknown'],['Paulownia'],['Paulownia tomentosa'],4,2,6.163714051246643 965,6712,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.20013158,ISDB,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,9.300526320934296 966,6711,80,Terpenoids,Steroids,Spirostane steroids,0.47881994,ISDB,KDMLORXVQJDOAH-GJJOIAPYSA-N,"InChI=1S/C35H58O12/c1-5-20-26(40)30(47-34(20,4)16-38)23(14-36)35(44)25(39)13-22-19-7-6-17-12-18(8-10-32(17,2)21(19)9-11-33(22,35)3)45-31-29(43)28(42)27(41)24(15-37)46-31/h7,17-18,20-31,36-44H,5-6,8-16H2,1-4H3/t17-,18-,20-,21-,22-,23+,24+,25-,26-,27+,28-,29+,30-,31+,32-,33-,34+,35+/m0/s1",CC[C@H]1[C@H](O)[C@H]([C@@H](CO)[C@@]2(O)[C@@H](O)C[C@H]3C4=CC[C@H]5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@@]32C)O[C@]1(C)CO,C35H58O12,,670.392827296,KDMLORXVQJDOAH,Terpenoids,Steroids,Stigmastane steroids,Ajuga salicifolia,5793032.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Ajuga'],['Ajuga salicifolia'],4,2,6.915279746055603 967,6706,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_1proton1ammonium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 968,6706,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_1proton1ammonium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 969,6706,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_1proton1ammonium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 970,6704,80,Terpenoids,Steroids,Spirostane steroids,0.46809444,ISDB,SQOIMYLIMNRUHZ-MPNCXHPSSA-N,"InChI=1S/C37H60O13/c1-6-22(39)32(44)47-25-14-36(45)27(40)11-19-20(35(36,5)13-24(25)48-33-31(43)30(42)29(41)26(15-38)49-33)8-9-34(4)21(19)12-23-28(34)18(3)37(50-23)10-7-17(2)16-46-37/h17-31,33,38-43,45H,6-16H2,1-5H3/t17-,18+,19-,20+,21+,22-,23+,24-,25-,26-,27-,28+,29-,30+,31-,33-,34+,35-,36+,37-/m1/s1",CC[C@@H](O)C(=O)O[C@@H]1C[C@]2(O)[C@H](O)C[C@H]3[C@@H]4C[C@@H]5O[C@]6(CC[C@@H](C)CO6)[C@@H](C)[C@@H]5[C@@]4(C)CC[C@@H]3[C@@]2(C)C[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C37H60O13,,712.40339198,SQOIMYLIMNRUHZ,Terpenoids,Steroids,Furostane steroids,Allium karataviense,942185.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium karataviense'],4,2,6.8723777532577515 971,6703,-1,,,,0.41479877,ISDB,XQLVDKRUFAHKFR-UHFFFAOYSA-N,"InChI=1S/C32H39NO3/c1-17-7-12-23-25-26(19(3)15-30(23,5)14-17)31(6)16-18(2)20(4)27-24(13-21-8-10-22(34)11-9-21)33-29(36)32(27,31)28(25)35/h8-11,15-17,20,23,25-26,34H,7,12-14H2,1-6H3,(H,33,36)",CC1=CC2(C)C3C(C)=CC4(C)CC(C)CCC4C3C(=O)C23C(=O)NC(Cc2ccc(O)cc2)=C3C1C,C32H39NO3,,485.292994108,XQLVDKRUFAHKFR,Amino acids and Peptides,Cyclic polyketides,3-Decalinoyltetramic acids,Diaporthaceae,660754.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Diaporthales'],['Diaporthaceae'],['Unknown'],['Unknown'],['Unknown'],1,0,2.659195065498352 972,6702,80,Terpenoids,Steroids,Spirostane steroids,0.34974524,ISDB,RZWFBNOFUAHADD-VTYRCZOESA-N,"InChI=1S/C34H50O6Si/c1-19-16-26(39-30(37)22(19)18-38-41(8,9)31(3,4)5)20(2)23-10-11-24-21-17-29-34(40-29)28(36)13-12-27(35)33(34,7)25(21)14-15-32(23,24)6/h12-13,20-21,23-26,29H,10-11,14-18H2,1-9H3/t20-,21-,23+,24-,25-,26+,29+,32+,33-,34+/m0/s1",CC1=C(CO[Si](C)(C)C(C)(C)C)C(=O)O[C@@H]([C@@H](C)[C@H]2CC[C@H]3[C@@H]4C[C@H]5O[C@]56C(=O)C=CC(=O)[C@]6(C)[C@H]4CC[C@]23C)C1,C34H50O6Si,,582.3376658499999,RZWFBNOFUAHADD,Terpenoids,Steroids,Ergostane steroids,Withania aristata,387708.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Physaleae'],['Withania'],['Withania aristata'],4,2,6.398980975151062 973,6699,80,Terpenoids,Steroids,Spirostane steroids,0.6125788,ISDB,UWLLQQJHSYZGDW-BFZFRUQESA-N,"InChI=1S/C33H54O10/c1-15-9-25(36)33(40-14-15)16(2)26-23(43-33)12-20-18-11-22(41-30-29(39)28(38)27(37)24(13-34)42-30)21-10-17(35)5-7-31(21,3)19(18)6-8-32(20,26)4/h15-30,34-39H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,22+,23+,24-,25+,26+,27-,28+,29-,30-,31-,32+,33+/m1/s1",C[C@H]1CO[C@@]2(O[C@H]3C[C@H]4[C@@H]5C[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H]6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2C)[C@@H](O)C1,C33H54O10,,610.371697928,UWLLQQJHSYZGDW,Terpenoids,Steroids,Spirostane steroids,Furcraea foetida,643224.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Furcraea'],['Furcraea gigantea'],4,3,7.950315237045288 974,6699,80,Terpenoids,Steroids,Spirostane steroids,0.6125788,ISDB,UWLLQQJHSYZGDW-BFZFRUQESA-N,"InChI=1S/C33H54O10/c1-15-9-25(36)33(40-14-15)16(2)26-23(43-33)12-20-18-11-22(41-30-29(39)28(38)27(37)24(13-34)42-30)21-10-17(35)5-7-31(21,3)19(18)6-8-32(20,26)4/h15-30,34-39H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,22+,23+,24-,25+,26+,27-,28+,29-,30-,31-,32+,33+/m1/s1",C[C@H]1CO[C@@]2(O[C@H]3C[C@H]4[C@@H]5C[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H]6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2C)[C@@H](O)C1,C33H54O10,,610.371697928,UWLLQQJHSYZGDW,Terpenoids,Steroids,Spirostane steroids,Agave utahensis,3996063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Agave'],['Agave utahensis'],4,3,7.950315237045288 975,6697,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JDPPHKXCSVHYOR-UHFFFAOYSA-N,"InChI=1S/C29H44O13/c1-15(2)9-22(32)41-24(17(5)6)26(34)37-12-20-13-38-27(42-23(33)10-16(3)4)25-28(20,35)11-21(40-19(8)31)29(25,36)14-39-18(7)30/h13,15-17,21,24-25,27,35-36H,9-12,14H2,1-8H3",CC(=O)OCC1(O)C(OC(C)=O)CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C21,C29H44O13,pos_1_1proton1ammonium,600.2781914679999,JDPPHKXCSVHYOR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 976,6697,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JDPPHKXCSVHYOR-LTIRXJMASA-N,"InChI=1S/C29H44O13/c1-15(2)9-22(32)41-24(17(5)6)26(34)37-12-20-13-38-27(42-23(33)10-16(3)4)25-28(20,35)11-21(40-19(8)31)29(25,36)14-39-18(7)30/h13,15-17,21,24-25,27,35-36H,9-12,14H2,1-8H3/t21-,24+,25-,27-,28-,29+/m0/s1",CC(=O)OC[C@@]1(O)[C@@H](OC(C)=O)C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@H]12,C29H44O13,pos_1_1proton1ammonium,600.278191468,JDPPHKXCSVHYOR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 977,6697,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JDPPHKXCSVHYOR-XCUDLWSTSA-N,"InChI=1S/C29H44O13/c1-15(2)9-22(32)41-24(17(5)6)26(34)37-12-20-13-38-27(42-23(33)10-16(3)4)25-28(20,35)11-21(40-19(8)31)29(25,36)14-39-18(7)30/h13,15-17,21,24-25,27,35-36H,9-12,14H2,1-8H3/t21-,24?,25-,27-,28-,29+/m0/s1",CC(=O)OC[C@@]1(O)[C@@H](OC(C)=O)C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@H]12,C29H44O13,pos_1_1proton1ammonium,600.278191468,JDPPHKXCSVHYOR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 978,6697,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JDPPHKXCSVHYOR-UHFFFAOYSA-N,"InChI=1S/C29H44O13/c1-15(2)9-22(32)41-24(17(5)6)26(34)37-12-20-13-38-27(42-23(33)10-16(3)4)25-28(20,35)11-21(40-19(8)31)29(25,36)14-39-18(7)30/h13,15-17,21,24-25,27,35-36H,9-12,14H2,1-8H3",CC(=O)OCC1(O)C(OC(C)=O)CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C21,C29H44O13,pos_1_1proton1ammonium,600.2781914679999,JDPPHKXCSVHYOR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 979,6697,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JDPPHKXCSVHYOR-LTIRXJMASA-N,"InChI=1S/C29H44O13/c1-15(2)9-22(32)41-24(17(5)6)26(34)37-12-20-13-38-27(42-23(33)10-16(3)4)25-28(20,35)11-21(40-19(8)31)29(25,36)14-39-18(7)30/h13,15-17,21,24-25,27,35-36H,9-12,14H2,1-8H3/t21-,24+,25-,27-,28-,29+/m0/s1",CC(=O)OC[C@@]1(O)[C@@H](OC(C)=O)C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@H]12,C29H44O13,pos_1_1proton1ammonium,600.278191468,JDPPHKXCSVHYOR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 980,6697,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JDPPHKXCSVHYOR-XCUDLWSTSA-N,"InChI=1S/C29H44O13/c1-15(2)9-22(32)41-24(17(5)6)26(34)37-12-20-13-38-27(42-23(33)10-16(3)4)25-28(20,35)11-21(40-19(8)31)29(25,36)14-39-18(7)30/h13,15-17,21,24-25,27,35-36H,9-12,14H2,1-8H3/t21-,24?,25-,27-,28-,29+/m0/s1",CC(=O)OC[C@@]1(O)[C@@H](OC(C)=O)C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@H]12,C29H44O13,pos_1_1proton1ammonium,600.278191468,JDPPHKXCSVHYOR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 981,6695,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2076714,ISDB,SGHMUAWQXUYUAJ-JALQXBGLSA-N,"InChI=1S/C27H36O11/c1-14-8-16(28)11-27(2,3)17(14)12-37-26-25(33)24(32)23(31)20(38-26)13-36-21(29)7-6-15-9-18(34-4)22(30)19(10-15)35-5/h6-10,17,20,23-26,30-33H,11-13H2,1-5H3/b7-6+/t17-,20+,23+,24-,25+,26+/m0/s1",COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC[C@H]3C(C)=CC(=O)CC3(C)C)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O,C27H36O11,,536.2257619719999,SGHMUAWQXUYUAJ,Terpenoids,,,Gardenia jasminoides,919367.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Gardenieae'],['Gardenia'],['Gardenia jasminoides'],4,1,5.330685615539551 982,6694,646,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.51427764,ISDB,HPPDWCXQOXACSB-SCZZXKLOSA-N,"InChI=1S/C10H12O3/c1-6(4-11)8-3-10(13)7(2)9(8)5-12/h4-5,8,10,13H,1,3H2,2H3/t8-,10+/m1/s1",C=C(C=O)[C@H]1C[C@H](O)C(C)=C1C=O,C10H12O3,,180.078644244,HPPDWCXQOXACSB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,9.55711054801941 983,6693,80,Terpenoids,Steroids,Spirostane steroids,0.56008935,ISDB,NWIZKMVCQBSUSU-PXVCSFTMSA-N,"InChI=1S/C33H54O11/c1-15-5-10-33(41-14-15)16(2)24-21(43-33)11-19-17-6-9-32(44-29-27(39)26(38)25(37)22(13-34)42-29)28(40)20(35)12-23(36)31(32,4)18(17)7-8-30(19,24)3/h15-29,34-40H,5-14H2,1-4H3/t15-,16+,17-,18+,19+,20+,21+,22-,23-,24+,25-,26+,27-,28+,29+,30+,31+,32+,33-/m1/s1",C[C@@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC[C@]5(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@@H](O)C[C@@H](O)[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C,C33H54O11,,626.366612548,NWIZKMVCQBSUSU,Terpenoids,Steroids,Spirostane steroids,Reineckea carnea,424242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Reineckea'],['Reineckea carnea'],4,3,7.740357398986816 984,6690,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.62173945,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea prunifolia,7606947.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea prunifolia'],4,3,7.986957788467407 985,6690,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.62173945,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea jamaicensis,431707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea jamaicensis'],4,3,7.986957788467407 986,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,3,8.5 987,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,3,8.5 988,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 989,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,3,8.5 990,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 991,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 992,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 993,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,3,8.5 994,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 995,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,3,8.5 996,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 997,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 998,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 999,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,3,8.5 1000,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1001,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1002,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1003,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1004,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1005,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1006,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1007,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1008,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1009,6688,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1010,6687,1036,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.37724003,ISDB,DNZSCKMZMWYBGM-ZCFIWIBFSA-N,"InChI=1S/C12H12O5/c1-6-5-8-7(11(14)16-2)3-4-9(13)10(8)12(15)17-6/h3-4,6,13H,5H2,1-2H3/t6-/m1/s1",COC(=O)c1ccc(O)c2c1C[C@@H](C)OC2=O,C12H12O5,,236.068473484,DNZSCKMZMWYBGM,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Picea glauca,771681.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Unknown'],['Pinales'],['Pinaceae'],['Unknown'],['Picea'],['Picea glauca'],3,3,6.008960127830505 1011,6685,-1,,,,0.0,MS1_match,VESROWPDCSMBRM-RMTQGBGSSA-N,"InChI=1S/C14H22O2/c1-9-4-5-11(8-10(2)15)14-12(9)6-7-13(14,3)16-14/h9,11-12H,4-8H2,1-3H3/t9-,11+,12-,13+,14-/m1/s1",CC(=O)C[C@@H]1CC[C@@H](C)[C@H]2CC[C@]3(C)O[C@]123,C14H22O2,pos_2MCH3CNNa,222.161979944,VESROWPDCSMBRM,Terpenoids,Sesquiterpenoids,Arteminisin,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1012,6683,-1,,,,0.59711283,ISDB,AVUHOKYBXFNEMN-JHRAIPKGSA-N,"InChI=1S/C16H26O3/c1-2-3-4-9-12-15(17)13-10-7-5-6-8-11-14-16(18)19/h3-4,7,9-10,12,15,17H,2,5-6,8,11,13-14H2,1H3,(H,18,19)/b4-3-,10-7-,12-9+/t15-/m0/s1",CC/C=C\C=C\[C@H](O)C/C=C\CCCCCC(=O)O,C16H26O3,,266.188194692,AVUHOKYBXFNEMN,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Elodea canadensis,1070307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Hydrocharitaceae'],['Unknown'],['Elodea'],['Elodea canadensis'],4,0,6.388451337814331 1013,6682,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.579689,ISDB,BCIWKKMTBRYQJU-INIZCTEOSA-N,"InChI=1S/C19H30O4/c1-3-4-5-6-7-8-16(20)14-17(21)11-9-15-10-12-18(22)19(13-15)23-2/h10,12-13,16,20,22H,3-9,11,14H2,1-2H3/t16-/m0/s1",CCCCCCC[C@H](O)CC(=O)CCc1ccc(O)c(OC)c1,C19H30O4,,322.21440943999994,BCIWKKMTBRYQJU,,,,Zingiber officinale,1063866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Zingiber'],['Zingiber officinale'],4,0,6.318756103515625 1014,6682,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.579689,ISDB,BCIWKKMTBRYQJU-UHFFFAOYSA-N,"InChI=1S/C19H30O4/c1-3-4-5-6-7-8-16(20)14-17(21)11-9-15-10-12-18(22)19(13-15)23-2/h10,12-13,16,20,22H,3-9,11,14H2,1-2H3",CCCCCCCC(O)CC(=O)CCc1ccc(O)c(OC)c1,C19H30O4,,322.21440943999994,BCIWKKMTBRYQJU,,,,Zingiber zerumbet,733243.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Zingiber'],['Zingiber zerumbet'],4,0,6.318756103515625 1015,6682,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.579689,ISDB,BCIWKKMTBRYQJU-UHFFFAOYSA-N,"InChI=1S/C19H30O4/c1-3-4-5-6-7-8-16(20)14-17(21)11-9-15-10-12-18(22)19(13-15)23-2/h10,12-13,16,20,22H,3-9,11,14H2,1-2H3",CCCCCCCC(O)CC(=O)CCc1ccc(O)c(OC)c1,C19H30O4,,322.21440943999994,BCIWKKMTBRYQJU,,,,Zingiber,730913.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Zingiber'],['Unknown'],4,0,6.318756103515625 1016,6677,-1,,,,0.0,MS1_match,FCQBGPOADKWYEG-MNRUEBDGSA-N,"InChI=1S/C38H40O10/c1-23-20-29(40)32(45-24(2)39)37(22-44-33(41)25-14-8-5-9-15-25)30(46-34(42)26-16-10-6-11-17-26)21-28-31(38(23,37)48-36(28,3)4)47-35(43)27-18-12-7-13-19-27/h5-19,23,28-32,40H,20-22H2,1-4H3/t23-,28-,29+,30+,31-,32+,37-,38-/m1/s1",CC(=O)O[C@H]1[C@@H](O)C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]12COC(=O)c1ccccc1)[C@H]3OC(=O)c1ccccc1,C38H40O10,pos_1_1proton1methanol,656.26214748,FCQBGPOADKWYEG,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Microtropis fokienensis,1015845.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis fokienensis'],6,0,6.0 1017,6677,-1,,,,0.0,MS1_match,ZKSJYLLIQBNONM-MYQHGJAJSA-N,"InChI=1S/C38H40O10/c1-23-20-29(45-24(2)39)31(40)37(22-44-33(41)25-14-8-5-9-15-25)30(46-34(42)26-16-10-6-11-17-26)21-28-32(38(23,37)48-36(28,3)4)47-35(43)27-18-12-7-13-19-27/h5-19,23,28-32,40H,20-22H2,1-4H3/t23-,28-,29+,30+,31+,32-,37-,38-/m1/s1",CC(=O)O[C@H]1C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(COC(=O)c2ccccc2)[C@H]1O)[C@H]3OC(=O)c1ccccc1,C38H40O10,pos_1_1proton1methanol,656.26214748,ZKSJYLLIQBNONM,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Microtropis fokienensis,1015845.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis fokienensis'],6,0,6.0 1018,6677,-1,,,,0.0,MS1_match,KRIXKONSAFPFFK-UHFFFAOYSA-N,"InChI=1S/C38H40O10/c1-22-21-27(45-33(41)24-15-9-6-10-16-24)31(44-23(2)39)37(5)32(47-35(43)26-19-13-8-14-20-26)29(46-34(42)25-17-11-7-12-18-25)28-30(40)38(22,37)48-36(28,3)4/h6-20,22,27-32,40H,21H2,1-5H3",CC(=O)OC1C(OC(=O)c2ccccc2)CC(C)C23OC(C)(C)C(C(OC(=O)c4ccccc4)C(OC(=O)c4ccccc4)C12C)C3O,C38H40O10,pos_1_1proton1methanol,656.26214748,KRIXKONSAFPFFK,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus rosthornianus,458804.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus rosthornianus'],6,0,6.0 1019,6677,-1,,,,0.0,MS1_match,LJHPXWBIYHMNIM-GXEJTTBMSA-N,"InChI=1S/C38H40O10/c1-22-21-27(40)31(47-33(41)24-15-9-6-10-16-24)37(5)30(35(43)46-26-19-13-8-14-20-26)28(34(42)45-25-17-11-7-12-18-25)29-32(44-23(2)39)38(22,37)48-36(29,3)4/h6-20,22,27-32,40H,21H2,1-5H3/t22-,27+,28-,29-,30+,31+,32-,37-,38-/m1/s1",CC(=O)O[C@@H]1[C@H]2[C@@H](C(=O)Oc3ccccc3)[C@@H](C(=O)Oc3ccccc3)[C@]3(C)[C@@H](OC(=O)c4ccccc4)[C@@H](O)C[C@@H](C)[C@@]13OC2(C)C,C38H40O10,pos_1_1proton1methanol,656.26214748,LJHPXWBIYHMNIM,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 1020,6677,-1,,,,0.0,MS1_match,AHUFIGKVFOERTN-RSWJJYNZSA-N,"InChI=1S/C38H40O10/c1-22-21-27(40)30(46-34(42)25-17-11-7-12-18-25)37(5)32(47-35(43)26-19-13-8-14-20-26)29(45-33(41)24-15-9-6-10-16-24)28-31(44-23(2)39)38(22,37)48-36(28,3)4/h6-20,22,27-32,40H,21H2,1-5H3/t22-,27+,28-,29-,30+,31-,32-,37+,38-/m1/s1",CC(=O)O[C@@H]1[C@H]2[C@@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@]3(C)[C@@H](OC(=O)c4ccccc4)[C@@H](O)C[C@@H](C)[C@@]13OC2(C)C,C38H40O10,pos_1_1proton1methanol,656.26214748,AHUFIGKVFOERTN,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 1021,6676,1436,Terpenoids,Octadecanoids,Other Octadecanoids,0.23932849,ISDB,VBBXZFLAYWAXSK-YRNVUSSQSA-N,"InChI=1S/C17H24O4/c1-9-5-6-13(7-11(3)17(19)20)15-10(2)8-14(16(9)15)21-12(4)18/h7,9,13-14,16H,5-6,8H2,1-4H3,(H,19,20)/b11-7+",CC(=O)OC1CC(C)=C2C(/C=C(\C)C(=O)O)CCC(C)C21,C17H24O4,,292.167459248,VBBXZFLAYWAXSK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,1,7.45731395483017 1022,6676,1436,Terpenoids,Octadecanoids,Other Octadecanoids,0.23932849,ISDB,VBBXZFLAYWAXSK-RONQOHQESA-N,"InChI=1S/C17H24O4/c1-9-5-6-13(7-11(3)17(19)20)15-10(2)8-14(16(9)15)21-12(4)18/h7,9,13-14,16H,5-6,8H2,1-4H3,(H,19,20)/b11-7+/t9-,13+,14+,16+/m1/s1",CC(=O)O[C@H]1CC(C)=C2[C@H]1[C@H](C)CC[C@H]2/C=C(\C)C(=O)O,C17H24O4,,292.167459248,VBBXZFLAYWAXSK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,7.45731395483017 1023,6674,261,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,MILUXBBEUPIOMH-NCKFJCGRSA-N,"InChI=1S/C32H52O5/c1-8-36-26-32-10-9-21-29(5,22(32)17-20(33)24(37-26)19(32)2)14-16-31(7)23-18-28(4,25(34)35)12-11-27(23,3)13-15-30(21,31)6/h19-24,26,33H,8-18H2,1-7H3,(H,34,35)/t19-,20+,21-,22-,23+,24+,26+,27+,28+,29+,30+,31-,32+/m0/s1",CCO[C@@H]1O[C@H]2[C@H](O)C[C@H]3[C@]4(C)CC[C@@]5(C)[C@@H]6C[C@](C)(C(=O)O)CC[C@]6(C)CC[C@]5(C)[C@H]4CC[C@]13[C@H]2C,C32H52O5,pos_1_sodium,516.381474764,MILUXBBEUPIOMH,Terpenoids,Triterpenoids,Friedelane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 1024,6671,934,Terpenoids,Steroids,Pregnane steroids,0.0,MS1_match,RJKFOVLPORLFTN-LEKSSAKUSA-N,"InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1",CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,C21H30O2,pos_2MH,314.2245802,RJKFOVLPORLFTN,Terpenoids,Steroids,Pregnane steroids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1025,6661,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.80421656,ISDB,REFJWTPEDVJJIY-UHFFFAOYSA-N,"InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H",O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O7,,302.04265266,REFJWTPEDVJJIY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,3,11.716866254806519 1026,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1027,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1028,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1029,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1030,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1031,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1032,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1033,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1034,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1035,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1036,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1037,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1038,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1039,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1040,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MHNH3,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1041,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MHNH3,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1042,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1043,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1044,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1045,6660,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1046,6659,391,Alkaloids,Ornithine alkaloids,Polyamines,0.33987343,ISDB,,,,,,,BNJUSZBEUIOHKF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3594937324523926 1047,6652,137,Alkaloids,Lysine alkaloids,Polyamines,0.0,MS1_match,QGMXLNCOBCGXMO-HNNXBMFYSA-N,"InChI=1S/C16H25N3O2/c20-16-13-15(14-7-2-1-3-8-14)17-9-4-5-11-19(21)12-6-10-18-16/h1-3,7-8,15,17,21H,4-6,9-13H2,(H,18,20)/t15-/m0/s1",O=C1C[C@@H](c2ccccc2)NCCCCN(O)CCCN1,C16H25N3O2,pos_1_1proton1methanol,291.19467704,QGMXLNCOBCGXMO,Alkaloids,Ornithine alkaloids,Polyamines,Maytenus buxifolia,1060181.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus buxifolia'],6,3,7.5 1048,6651,-1,,,,0.23076408,ISDB,,,,,,,IKMACLPPKYTRBX,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9230563044548035 1049,6650,137,Alkaloids,Lysine alkaloids,Polyamines,0.47071066,ISDB,PSOQPSXOOXHHBU-UHFFFAOYSA-N,"InChI=1S/C22H31NO/c1-14-18-6-7-20-17-5-4-15-12-16(24)8-10-21(15,2)19(17)9-11-22(18,20)13-23(14)3/h8,10,12,14,17-20H,4-7,9,11,13H2,1-3H3",CC1C2CCC3C4CCC5=CC(=O)C=CC5(C)C4CCC32CN1C,C22H31NO,,325.240564612,PSOQPSXOOXHHBU,Alkaloids,Pseudoalkaloids,Steroidal alkaloids,Holarrhena pubescens,495827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Malouetieae'],['Holarrhena'],['Holarrhena pubescens'],4,1,6.382842659950256 1050,6650,137,Alkaloids,Lysine alkaloids,Polyamines,0.47071066,ISDB,PSOQPSXOOXHHBU-TVDWCQHHSA-N,"InChI=1S/C22H31NO/c1-14-18-6-7-20-17-5-4-15-12-16(24)8-10-21(15,2)19(17)9-11-22(18,20)13-23(14)3/h8,10,12,14,17-20H,4-7,9,11,13H2,1-3H3/t14-,17-,18+,19-,20-,21+,22+/m0/s1",C[C@H]1[C@H]2CC[C@H]3[C@H]4CCC5=CC(=O)C=C[C@@]5(C)[C@H]4CC[C@@]23CN1C,C22H31NO,,325.240564612,PSOQPSXOOXHHBU,Alkaloids,Pseudoalkaloids,Steroidal alkaloids,Holarrhena floribunda,3870702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Malouetieae'],['Holarrhena'],['Holarrhena floribunda'],4,1,6.382842659950256 1051,6650,137,Alkaloids,Lysine alkaloids,Polyamines,0.47071066,ISDB,PSOQPSXOOXHHBU-LJZXKFISSA-N,"InChI=1S/C22H31NO/c1-14-18-6-7-20-17-5-4-15-12-16(24)8-10-21(15,2)19(17)9-11-22(18,20)13-23(14)3/h8,10,12,14,17-20H,4-7,9,11,13H2,1-3H3/t14-,17+,18+,19-,20-,21-,22-/m0/s1",C[C@H]1[C@H]2CC[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4CC[C@]23CN1C,C22H31NO,,325.24056461200007,PSOQPSXOOXHHBU,Alkaloids,Pseudoalkaloids,Steroidal alkaloids,Wrightia antidysenterica,495827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Malouetieae'],['Holarrhena'],['Holarrhena pubescens'],4,1,6.382842659950256 1052,6647,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.74650025,ISDB,JDVDGNAHTZMMBI-UHFFFAOYSA-N,"InChI=1S/C21H36O3/c1-5-7-8-9-10-11-12-13-14-15-16-19-17(3)20(22)18(6-2)21(23-4)24-19/h5-16H2,1-4H3",CCCCCCCCCCCCc1oc(OC)c(CC)c(=O)c1C,C21H36O3,,336.266445012,JDVDGNAHTZMMBI,Polyketides,Cyclic polyketides,4-pyrone derivatives,Podolepis rugata,24091.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Podolepis'],['Podolepis rugata'],4,1,7.486001014709473 1053,6644,-1,,,,0.0,MS1_match,SGUOENJPMRQEMJ-PLNGHNRSSA-N,"InChI=1S/C19H34O9/c1-10(21)5-6-19(26)17(2,3)7-11(8-18(19,4)25)27-16-15(24)14(23)13(22)12(9-20)28-16/h5-6,10-16,20-26H,7-9H2,1-4H3/t10-,11-,12-,13-,14+,15-,16-,18+,19+/m1/s1",C[C@@H](O)C=C[C@]1(O)C(C)(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@]1(C)O,C19H34O9,pos_1_1potassium,406.220282668,SGUOENJPMRQEMJ,Terpenoids,Apocarotenoids,Megastigmanes,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1054,6644,-1,,,,0.0,MS1_match,FCSXIFYRVMQLAX-HPMNXYLDSA-N,"InChI=1S/C19H34O9/c1-10-6-12(7-18(2,3)19(10,26)5-4-11(22)8-20)27-17-16(25)15(24)14(23)13(9-21)28-17/h4-5,10-17,20-26H,6-9H2,1-3H3/b5-4+/t10-,11+,12+,13-,14+,15+,16-,17-,19-/m1/s1",C[C@@H]1C[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@@]1(O)/C=C/[C@H](O)CO,C19H34O9,pos_1_1potassium,406.220282668,FCSXIFYRVMQLAX,Terpenoids,Apocarotenoids,Megastigmanes,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 1055,6635,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2proton,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,0,8.0 1056,6635,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,UEHILKCNLIKLEV-FMYTYVRISA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26+,27+,28+,29+,30+,31-,32-,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@@H](O)[C@@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2proton,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 1057,6635,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2proton,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 1058,6635,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,GFPLPBCJRRNZHM-ICUGHKHQSA-N,"InChI=1S/C53H86O22/c1-23-32(57)36(61)40(65)44(70-23)74-42-33(58)26(56)20-68-46(42)73-31-11-12-49(4)29(50(31,5)22-55)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,17-15-51(24,52)6)47(67)75-45-41(66)38(63)35(60)28(72-45)21-69-43-39(64)37(62)34(59)27(19-54)71-43/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2proton,1074.5610743920006,GFPLPBCJRRNZHM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 1059,6633,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.0,MS1_match,FEJTUHSIRAJLOJ-UHFFFAOYSA-N,"InChI=1S/C13H14N2O3/c1-8-6-9-11(10(16)7-8)12(13(17)18)15-5-3-2-4-14(9)15/h6-7H,2-5H2,1H3,(H,17,18)",Cc1cc2n3n(c(C(=O)O)c-2c(=O)c1)CCCC3,C13H14N2O3,pos_2MHNH3,246.100442308,FEJTUHSIRAJLOJ,Alkaloids,,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,1,6.5 1060,6629,-1,,,,0.0,MS1_match,WPPWNTIQMVESCF-XEKQUVPHSA-N,"InChI=1S/C41H47NO16/c1-20-15-16-28-27(14-11-17-42-28)38(50)52-18-39(7)29-32(53-23(4)44)35(55-25(6)46)40(19-51-22(3)43)34(57-37(49)26-12-9-8-10-13-26)30(47)31(56-36(20)48)21(2)41(40,58-39)33(29)54-24(5)45/h8-14,17,20-21,29-35,47H,15-16,18-19H2,1-7H3/t20?,21-,29-,30+,31?,32-,33?,34+,35-,39?,40+,41-/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3C(OC(C)=O)[C@@]14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC([C@H]4C)[C@H](O)[C@@H]2OC(=O)c1ccccc1,C41H47NO16,pos_1_1proton1dmso,809.289484424,WPPWNTIQMVESCF,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,0,7.0 1061,6628,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.22258675,ISDB,CNLCQYMRNGWEJB-OERKHBLVSA-N,"InChI=1S/C13H20O4/c1-9-6-11(16)7-12(2,3)13(9,17)5-4-10(15)8-14/h4-6,10,14-15,17H,7-8H2,1-3H3/b5-4+/t10-,13+/m0/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](O)CO,C13H20O4,,240.13615912,CNLCQYMRNGWEJB,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Cucumis sativus,1006246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Benincaseae'],['Cucumis'],['Cucumis sativus'],4,3,6.390347003936768 1062,6628,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.22258675,ISDB,CNLCQYMRNGWEJB-OERKHBLVSA-N,"InChI=1S/C13H20O4/c1-9-6-11(16)7-12(2,3)13(9,17)5-4-10(15)8-14/h4-6,10,14-15,17H,7-8H2,1-3H3/b5-4+/t10-,13+/m0/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](O)CO,C13H20O4,,240.13615912,CNLCQYMRNGWEJB,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Cucumis sativus var. sativus,800021.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Benincaseae'],['Cucumis'],['Cucumis sativus'],4,3,6.390347003936768 1063,6628,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.22258675,ISDB,CNLCQYMRNGWEJB-OERKHBLVSA-N,"InChI=1S/C13H20O4/c1-9-6-11(16)7-12(2,3)13(9,17)5-4-10(15)8-14/h4-6,10,14-15,17H,7-8H2,1-3H3/b5-4+/t10-,13+/m0/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](O)CO,C13H20O4,,240.13615912,CNLCQYMRNGWEJB,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Brucea javanica,841359.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Simaroubaceae'],['Unknown'],['Brucea'],['Brucea javanica'],4,3,6.390347003936768 1064,6619,-1,,,,0.22283155,ISDB,,,,,,,CNAASNXQROGRGE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8913261890411377 1065,6618,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,10.495584607124329 1066,6618,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,10.495584607124329 1067,6618,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,10.495584607124329 1068,6618,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,10.495584607124329 1069,6618,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,10.495584607124329 1070,6617,-1,,,,0.0,MS1_match,IZQSVPBOUDKVDZ-UHFFFAOYSA-N,"InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3",COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O,C16H12O7,pos_2MH,316.058302724,IZQSVPBOUDKVDZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium semibarbatum,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 1071,6617,-1,,,,0.0,MS1_match,IZQSVPBOUDKVDZ-UHFFFAOYSA-N,"InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3",COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O,C16H12O7,pos_2MH,316.058302724,IZQSVPBOUDKVDZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium semibarbartum,3944980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbartum'],6,0,6.0 1072,6617,-1,,,,0.0,MS1_match,IZQSVPBOUDKVDZ-UHFFFAOYSA-N,"InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3",COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O,C16H12O7,pos_2MH,316.058302724,IZQSVPBOUDKVDZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium zalil,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 1073,6608,458,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_2MK,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1074,6608,458,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_2MK,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 1075,6603,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1076,6603,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-IZJUWVJPSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26+,27-,28+,29-,30+,33-,34+,35-,36-/m1/s1",CC(=O)OC[C@]12[C@@H](OC(C)=O)C(=O)[C@H]3[C@@H](OC(C)=O)[C@]14O[C@]3(C)COC(=O)c1cccnc1[C@H](C)[C@@H](C)C(=O)O[C@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,0,7.0 1077,6603,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 1078,6603,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1079,6603,-1,,,,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_sodium,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1080,6603,-1,,,,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_sodium,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1081,6601,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,ICJMGMIQWBNSNM-QRCQAKELSA-N,"InChI=1S/C42H48N2O18/c1-19-20(2)36(50)60-33-31(57-23(5)47)35(61-37(51)26-12-10-14-43-16-26)41(18-54-21(3)45)34(59-25(7)49)30(56-22(4)46)28-32(58-24(6)48)42(41,40(33,9)53)62-39(28,8)17-55-38(52)27-13-11-15-44-29(19)27/h10-16,19-20,28,30-35,53H,17-18H2,1-9H3/t19-,20+,28-,30-,31+,32-,33+,34-,35+,39+,40+,41-,42+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(=O)c1cccnc1)[C@]4(C)O,C42H48N2O18,pos_1_1proton,868.2902126960001,ICJMGMIQWBNSNM,,,,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,0,7.0 1082,6601,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,ICJMGMIQWBNSNM-QRCQAKELSA-N,"InChI=1S/C42H48N2O18/c1-19-20(2)36(50)60-33-31(57-23(5)47)35(61-37(51)26-12-10-14-43-16-26)41(18-54-21(3)45)34(59-25(7)49)30(56-22(4)46)28-32(58-24(6)48)42(41,40(33,9)53)62-39(28,8)17-55-38(52)27-13-11-15-44-29(19)27/h10-16,19-20,28,30-35,53H,17-18H2,1-9H3/t19-,20+,28-,30-,31+,32-,33+,34-,35+,39+,40+,41-,42+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(=O)c1cccnc1)[C@]4(C)O,C42H48N2O18,pos_1_1proton,868.2902126960001,ICJMGMIQWBNSNM,,,,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,0,7.0 1083,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 1084,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-UHFFFAOYSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 1085,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,6.0 1086,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 1087,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-UHFFFAOYSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 1088,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,6.0 1089,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 1090,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-UHFFFAOYSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 1091,6597,-1,,,,0.0,MS1_match,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,pos_1_sodium,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,6.0 1092,6595,801,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,ZYGHJZDHTFUPRJ-UHFFFAOYSA-N,InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,O=c1ccc2ccccc2o1,C9H6O2,pos_1_1proton,146.036779432,ZYGHJZDHTFUPRJ,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,3,7.5 1093,6592,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.27327982,ISDB,NVTLDVSBUJGIAD-QHBXHTPSSA-N,"InChI=1S/C45H38O21/c46-15-7-18(48)30-29(8-15)64-42(13-3-24(54)37(60)25(55)4-13)39(62)34(30)32-20(50)11-21(51)33-35(40(63)43(66-45(32)33)14-5-26(56)38(61)27(57)6-14)31-19(49)10-17(47)16-9-28(58)41(65-44(16)31)12-1-22(52)36(59)23(53)2-12/h1-8,10-11,28,34-35,39-43,46-63H,9H2/t28-,34-,35+,39-,40-,41+,42+,43+/m0/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)C2,C45H38O21,,914.1905582360004,NVTLDVSBUJGIAD,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,Ribes nigrum,248647.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Grossulariaceae'],['Unknown'],['Ribes'],['Ribes nigrum'],4,3,6.593119263648987 1094,6592,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.27327982,ISDB,NVTLDVSBUJGIAD-YXPYEDIHSA-N,"InChI=1S/C45H38O21/c46-15-7-18(48)30-29(8-15)64-42(13-3-24(54)37(60)25(55)4-13)39(62)34(30)32-20(50)11-21(51)33-35(40(63)43(66-45(32)33)14-5-26(56)38(61)27(57)6-14)31-19(49)10-17(47)16-9-28(58)41(65-44(16)31)12-1-22(52)36(59)23(53)2-12/h1-8,10-11,28,34-35,39-43,46-63H,9H2/t28-,34+,35-,39+,40+,41-,42-,43-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C45H38O21,,914.190558236,NVTLDVSBUJGIAD,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,Croton lechleri,900868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton lechleri'],4,3,6.593119263648987 1095,6591,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.9354539,ISDB,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,11.241815567016602 1096,6591,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.9354539,ISDB,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,11.241815567016602 1097,6591,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.9354539,ISDB,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,11.241815567016602 1098,6590,-1,,,,0.0,MS1_match,BSALBDFYJLSIOZ-AJVVGMEXSA-N,"InChI=1S/C29H48O3/c1-18(31)19-9-14-29(17-30)16-15-27(5)20(24(19)29)7-8-22-26(4)12-11-23(32)25(2,3)21(26)10-13-28(22,27)6/h19-24,30,32H,7-17H2,1-6H3/t19-,20+,21-,22+,23+,24+,26-,27+,28+,29+/m0/s1",CC(=O)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C29H48O3,pos_1_1proton1ammonium,444.360345396,BSALBDFYJLSIOZ,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,0,7.0 1099,6590,-1,,,,0.0,MS1_match,GXGBLBFUBDIUOT-KZDFMVMNSA-N,"InChI=1S/C29H48O3/c1-19-20(31)7-8-21-25(19,3)10-9-22-26(21,4)12-13-28(6)23-17-24(2,32)11-15-29(23,18-30)16-14-27(22,28)5/h19,21-23,30,32H,7-18H2,1-6H3/t19-,21+,22-,23-,24+,25+,26-,27+,28-,29+/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)CC[C@]3(CO)CC[C@]12C,C29H48O3,pos_1_1proton1ammonium,444.360345396,GXGBLBFUBDIUOT,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,0,7.0 1100,6588,2,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,DPKBLLFCUGWECD-GTYQNAEWSA-N,"InChI=1S/C28H46O3/c1-18-19(29)7-8-20-24(18,3)10-9-21-25(20,4)12-13-27(6)22-17-23(2,30)11-15-28(22,31)16-14-26(21,27)5/h18,20-22,30-31H,7-17H2,1-6H3/t18-,20+,21-,22-,23+,24+,25-,26+,27-,28-/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)CC[C@]3(O)CC[C@]12C,C28H46O3,pos_1_1potassium,430.344695332,DPKBLLFCUGWECD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,3,8.5 1101,6586,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,VZNBBVMTJYKZLE-VNSUZFEMSA-N,"InChI=1S/C36H45NO17/c1-10-17(2)31(44)53-29-26(49-19(4)39)30(52-22(7)42)35(16-47-18(3)38)28(51-21(6)41)25(43)24-27(50-20(5)40)36(35,34(29,9)46)54-33(24,8)15-48-32(45)23-12-11-13-37-14-23/h11-14,17,24,26-30,46H,10,15-16H2,1-9H3/t17-,24-,26+,27-,28-,29+,30+,33+,34+,35-,36+/m1/s1",CC[C@@H](C)C(=O)O[C@H]1[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]2(COC(C)=O)[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@]2(O[C@@]3(C)COC(=O)c2cccnc2)[C@@]1(C)O,C36H45NO17,pos_1_1proton,763.26874898,VZNBBVMTJYKZLE,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 1102,6586,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,VCRRHFSJEWAFJW-NTYBQZHASA-N,"InChI=1S/C36H45NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(49-18(3)39)29(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(50-19(4)40)28(53-31(16)44)34(8,46)36(35,54-33)27(24)43/h9-10,13,16,24-30,43,46H,11-12,14-15H2,1-8H3/t16-,24+,25+,26-,27-,28-,29+,30-,33+,34+,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@H](O)[C@@]14O[C@]3(C)COC(=O)c1cccnc1CC[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@@]4(C)O,C36H45NO17,pos_1_1proton,763.26874898,VCRRHFSJEWAFJW,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 1103,6585,891,,,,0.48964885,ISDB,,,,,,,CETJCAVHXCTDSZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.9585953950881958 1104,6584,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1105,6584,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-IZJUWVJPSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26+,27-,28+,29-,30+,33-,34+,35-,36-/m1/s1",CC(=O)OC[C@]12[C@@H](OC(C)=O)C(=O)[C@H]3[C@@H](OC(C)=O)[C@]14O[C@]3(C)COC(=O)c1cccnc1[C@H](C)[C@@H](C)C(=O)O[C@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,0,7.0 1106,6584,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 1107,6584,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1108,6584,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_1proton,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1109,6584,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_1proton,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1110,6582,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,SGYXRITWGDMMSS-OUWJXSMFSA-N,"InChI=1S/C38H47NO17/c1-17-12-13-26-25(11-10-14-39-26)35(47)49-15-36(9)27-29(50-20(4)41)32(53-23(7)44)37(16-48-19(3)40)33(54-24(8)45)30(51-21(5)42)28(55-34(17)46)18(2)38(37,56-36)31(27)52-22(6)43/h10-11,14,17-18,27-33H,12-13,15-16H2,1-9H3/t17-,18+,27-,28-,29-,30+,31+,32+,33+,36-,37+,38-/m0/s1",CC(=O)OC[C@@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(=O)[C@@H](C)CCc4ncccc4C(=O)OC[C@]4(C)O[C@@]1([C@@H]3C)[C@H](OC(C)=O)[C@@H]4[C@H](OC(C)=O)[C@H]2OC(C)=O,C38H47NO17,pos_1_sodium,789.284399044,SGYXRITWGDMMSS,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,8.5 1111,6581,-1,,,,0.0,MS1_match,LISHAQDJMDPPOF-TVUKNPRMSA-N,"InChI=1S/C34H39NO12/c1-19(36)42-18-33-24(43-20(2)37)14-15-32(6,41)34(33)27(44-21(3)38)25(31(4,5)47-34)26(45-29(39)22-11-8-7-9-12-22)28(33)46-30(40)23-13-10-16-35-17-23/h7-13,16-17,24-28,41H,14-15,18H2,1-6H3/t24-,25+,26+,27+,28+,32-,33-,34-/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(C)=O)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@@H](OC(=O)c1ccccc1)[C@H]2OC(=O)c1cccnc1)[C@H]3OC(C)=O,C34H39NO12,pos_1_sodium,653.247225688,LISHAQDJMDPPOF,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 1112,6581,-1,,,,0.0,MS1_match,BBAGKYDYEJAAKK-LTVCKWSDSA-N,"InChI=1S/C34H39NO12/c1-18-15-24(43-20(3)37)27(39)33(17-42-19(2)36)29(46-30(40)22-11-8-7-9-12-22)26(45-31(41)23-13-10-14-35-16-23)25-28(44-21(4)38)34(18,33)47-32(25,5)6/h7-14,16,18,24-29,39H,15,17H2,1-6H3/t18-,24+,25-,26-,27+,28-,29-,33+,34-/m1/s1",CC(=O)OC[C@]12[C@H](OC(=O)c3ccccc3)[C@H](OC(=O)c3cccnc3)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@H](C)C[C@H](OC(C)=O)[C@@H]2O,C34H39NO12,pos_1_sodium,653.247225688,BBAGKYDYEJAAKK,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,0,6.0 1113,6581,-1,,,,0.0,MS1_match,OSWYHQBZDXCTCZ-TVUKNPRMSA-N,"InChI=1S/C34H39NO12/c1-19(36)42-18-33-24(45-30(40)23-13-10-16-35-17-23)14-15-32(6,41)34(33)27(44-21(3)38)25(31(4,5)47-34)26(43-20(2)37)28(33)46-29(39)22-11-8-7-9-12-22/h7-13,16-17,24-28,41H,14-15,18H2,1-6H3/t24-,25+,26+,27+,28+,32-,33-,34-/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(=O)c3cccnc3)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1ccccc1)[C@H]3OC(C)=O,C34H39NO12,pos_1_sodium,653.247225688,OSWYHQBZDXCTCZ,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 1114,6581,-1,,,,0.0,MS1_match,OSWYHQBZDXCTCZ-TVUKNPRMSA-N,"InChI=1S/C34H39NO12/c1-19(36)42-18-33-24(45-30(40)23-13-10-16-35-17-23)14-15-32(6,41)34(33)27(44-21(3)38)25(31(4,5)47-34)26(43-20(2)37)28(33)46-29(39)22-11-8-7-9-12-22/h7-13,16-17,24-28,41H,14-15,18H2,1-6H3/t24-,25+,26+,27+,28+,32-,33-,34-/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(=O)c3cccnc3)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1ccccc1)[C@H]3OC(C)=O,C34H39NO12,pos_1_sodium,653.247225688,OSWYHQBZDXCTCZ,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.0 1115,6581,-1,,,,0.0,MS1_match,YDMQFVLNJYKGRK-DPWNUWMNSA-N,"InChI=1S/C34H39NO12/c1-19(36)42-18-33-26(45-29(39)22-11-8-7-9-12-22)15-24-27(44-21(3)38)34(33,47-31(24,4)5)32(6,41)16-25(43-20(2)37)28(33)46-30(40)23-13-10-14-35-17-23/h7-14,17,24-28,41H,15-16,18H2,1-6H3/t24-,25+,26+,27-,28+,32+,33-,34+/m1/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)C[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(=O)c1cccnc1,C34H39NO12,pos_1_sodium,653.247225688,YDMQFVLNJYKGRK,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,0,6.0 1116,6580,928,,,,0.3031313,ISDB,,,,,,,PGYLYGLYGRZSNC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2125252485275269 1117,6579,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MMHTXEATDNFMMY-WBIUFABUSA-N,"InChI=1S/C15H16O6/c1-15-6-12(18)10(16)5-9(15)8-3-7(20-2)4-11(17)13(8)14(19)21-15/h3-5,10,12,16-18H,6H2,1-2H3/t10-,12-,15-/m0/s1",COc1cc(O)c2c(c1)C1=C[C@H](O)[C@@H](O)C[C@]1(C)OC2=O,C15H16O6,pos_1_1proton,292.094688232,MMHTXEATDNFMMY,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Gymnosporia acuminata,906995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus hookeri'],6,1,6.5 1118,6579,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MMHTXEATDNFMMY-WBIUFABUSA-N,"InChI=1S/C15H16O6/c1-15-6-12(18)10(16)5-9(15)8-3-7(20-2)4-11(17)13(8)14(19)21-15/h3-5,10,12,16-18H,6H2,1-2H3/t10-,12-,15-/m0/s1",COc1cc(O)c2c(c1)C1=C[C@H](O)[C@@H](O)C[C@]1(C)OC2=O,C15H16O6,pos_1_1proton,292.094688232,MMHTXEATDNFMMY,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Gymnosporia acuminata,906995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus hookeri'],6,1,6.5 1119,6574,-1,,,,0.0,MS1_match,JOZKFWLRHCDGJA-LLVKDONJSA-N,"InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3/t11-/m1/s1",CC(=O)OCC[C@H](C)CCC=C(C)C,C12H22O2,pos_2MH,198.161979944,JOZKFWLRHCDGJA,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1120,6573,-1,,,,0.0,MS1_match,DHLFYSNOCHUPMP-ZIBOQDOISA-N,"InChI=1S/C34H40O16/c1-16-26(45-18(3)36)27(46-19(4)37)30(49-22(7)40)33(15-43-17(2)35)29(48-21(6)39)25(41)24-28(47-20(5)38)34(16,33)50-32(24,8)14-44-31(42)23-12-10-9-11-13-23/h9-13,16,24,26-30H,14-15H2,1-8H3/t16-,24-,26-,27+,28-,29-,30+,32+,33-,34-/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(O[C@@]3(C)COC(=O)c1ccccc1)[C@H](C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O,C34H40O16,pos_1_1sodium1acetonitrile,704.2316352,DHLFYSNOCHUPMP,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,0,7.0 1121,6573,-1,,,,0.0,MS1_match,HIZXOIDYACHULC-MOTSPOBHSA-N,"InChI=1S/C36H43NO16/c1-15-16(2)32(44)52-27-17(3)36-29(49-20(6)40)24(34(9,53-36)13-47-33(45)23-11-10-12-37-25(15)23)26(43)30(50-21(7)41)35(36,14-46-18(4)38)31(51-22(8)42)28(27)48-19(5)39/h10-12,15-17,24,27-31H,13-14H2,1-9H3/t15-,16-,17+,24?,27+,28+,29+,30+,31+,34+,35-,36+/m0/s1",CC(=O)OC[C@@]12[C@H](OC(C)=O)C(=O)C3[C@@H](OC(C)=O)[C@@]14O[C@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@@H](OC(C)=O)[C@H]2OC(C)=O)[C@H]4C,C36H43NO16,pos_1_sodium,745.258184296,HIZXOIDYACHULC,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,0,7.0 1122,6572,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.6453372,ISDB,SBLKVIQSIHEQOF-UHFFFAOYSA-N,"InChI=1S/C18H32O4/c19-17(20)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(21)22/h1-2H,3-16H2,(H,19,20)(H,21,22)",O=C(O)CCCCCCCC=CCCCCCCCC(=O)O,C18H32O4,,312.230059504,SBLKVIQSIHEQOF,Fatty acids,Fatty Acids and Conjugates,Dicarboxylic acids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,2,7.581348896026611 1123,6570,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,ZTDLEPCPWDWZOM-IOQDTQQCSA-N,"InChI=1S/C30H26O12/c31-16-6-1-14(2-7-16)3-10-23(35)40-13-22-26(36)28(38)29(39)30(42-22)25-19(34)12-21-24(27(25)37)18(33)11-20(41-21)15-4-8-17(32)9-5-15/h1-12,22,26,28-32,34,36-39H,13H2/b10-3+/t22-,26-,28+,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](c2c(O)cc3oc(-c4ccc(O)cc4)cc(=O)c3c2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O12,pos_1_1proton,578.142426272,ZTDLEPCPWDWZOM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,2,9.0 1124,6570,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,UTUISHMYVAZILQ-UHFFFAOYSA-N,"InChI=1S/C30H26O12/c31-14-24-29(42-25(36)10-3-15-1-6-17(32)7-2-15)27(37)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2",O=C(C=Cc1ccc(O)cc1)OC1C(CO)OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)C(O)C1O,C30H26O12,pos_1_1proton,578.142426272,UTUISHMYVAZILQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,2,9.0 1125,6568,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1126,6568,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-IZJUWVJPSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26+,27-,28+,29-,30+,33-,34+,35-,36-/m1/s1",CC(=O)OC[C@]12[C@@H](OC(C)=O)C(=O)[C@H]3[C@@H](OC(C)=O)[C@]14O[C@]3(C)COC(=O)c1cccnc1[C@H](C)[C@@H](C)C(=O)O[C@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,0,7.0 1127,6568,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 1128,6568,-1,,,,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_sodium,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1129,6568,-1,,,,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_sodium,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1130,6568,-1,,,,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_sodium,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1131,6567,-1,,,,0.0,MS1_match,HJOAQEYWNOPRHE-LCENJUANSA-N,"InChI=1S/C27H34O15/c1-10-4-13(29)18-14(30)5-15-12(25(18)40-10)3-2-11(7-37-15)8-38-26-24(36)22(34)20(32)17(42-26)9-39-27-23(35)21(33)19(31)16(6-28)41-27/h2,4-5,16-17,19-24,26-28,30-36H,3,6-9H2,1H3/t16-,17-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)CC=C(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O15,pos_1_1proton1acetonitrile,598.189770388,HJOAQEYWNOPRHE,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 1132,6567,-1,,,,0.0,MS1_match,HJOAQEYWNOPRHE-LCENJUANSA-N,"InChI=1S/C27H34O15/c1-10-4-13(29)18-14(30)5-15-12(25(18)40-10)3-2-11(7-37-15)8-38-26-24(36)22(34)20(32)17(42-26)9-39-27-23(35)21(33)19(31)16(6-28)41-27/h2,4-5,16-17,19-24,26-28,30-36H,3,6-9H2,1H3/t16-,17-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)CC=C(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O15,pos_1_1proton1acetonitrile,598.189770388,HJOAQEYWNOPRHE,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 1133,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1134,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1135,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1136,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1137,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1138,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1139,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1140,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1141,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1142,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1143,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1144,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1145,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1146,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1147,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1148,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1149,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1150,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1151,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1152,6566,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1153,6563,137,Alkaloids,Lysine alkaloids,Polyamines,0.5704854,ISDB,YUVGUUFSLOQITK-HZJYTTRNSA-N,"InChI=1S/C24H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-21-20-24(26)22-18-15-16-19-23(22)25-21/h6-7,9-10,15-16,18-20H,2-5,8,11-14,17H2,1H3,(H,25,26)/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCc1cc(=O)c2ccccc2[nH]1,C24H33NO,,351.25621467600007,YUVGUUFSLOQITK,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Tetradium ruticarpum,976536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Tetradium'],['Tetradium ruticarpum'],4,1,6.781941652297974 1154,6562,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.6703609,ISDB,KKNRLFRQWDXUQD-UHFFFAOYSA-N,"InChI=1S/C20H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h6-7,9-10,21H,2-5,8,11-19H2,1H3",CCCCCC=CCC=CCCCCCCCC(=O)OCCO,C20H36O3,,324.266445012,KKNRLFRQWDXUQD,Fatty acids,Fatty esters,Wax monoesters,Tagetes erecta,717584.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Tageteae'],['Tagetes'],['Tagetes erecta'],4,1,7.181443691253662 1155,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1156,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1157,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1158,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1159,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1160,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1161,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1162,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1163,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1164,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1165,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1166,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1167,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1168,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1169,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1170,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1171,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1172,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_sodium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1173,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_sodium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1174,6558,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1175,6556,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,SGYXRITWGDMMSS-OUWJXSMFSA-N,"InChI=1S/C38H47NO17/c1-17-12-13-26-25(11-10-14-39-26)35(47)49-15-36(9)27-29(50-20(4)41)32(53-23(7)44)37(16-48-19(3)40)33(54-24(8)45)30(51-21(5)42)28(55-34(17)46)18(2)38(37,56-36)31(27)52-22(6)43/h10-11,14,17-18,27-33H,12-13,15-16H2,1-9H3/t17-,18+,27-,28-,29-,30+,31+,32+,33+,36-,37+,38-/m0/s1",CC(=O)OC[C@@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(=O)[C@@H](C)CCc4ncccc4C(=O)OC[C@]4(C)O[C@@]1([C@@H]3C)[C@H](OC(C)=O)[C@@H]4[C@H](OC(C)=O)[C@H]2OC(C)=O,C38H47NO17,pos_1_1proton,789.284399044,SGYXRITWGDMMSS,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,8.5 1176,6555,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,SGYXRITWGDMMSS-OUWJXSMFSA-N,"InChI=1S/C38H47NO17/c1-17-12-13-26-25(11-10-14-39-26)35(47)49-15-36(9)27-29(50-20(4)41)32(53-23(7)44)37(16-48-19(3)40)33(54-24(8)45)30(51-21(5)42)28(55-34(17)46)18(2)38(37,56-36)31(27)52-22(6)43/h10-11,14,17-18,27-33H,12-13,15-16H2,1-9H3/t17-,18+,27-,28-,29-,30+,31+,32+,33+,36-,37+,38-/m0/s1",CC(=O)OC[C@@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(=O)[C@@H](C)CCc4ncccc4C(=O)OC[C@]4(C)O[C@@]1([C@@H]3C)[C@H](OC(C)=O)[C@@H]4[C@H](OC(C)=O)[C@H]2OC(C)=O,C38H47NO17,pos_1_sodium,789.284399044,SGYXRITWGDMMSS,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,8.5 1177,6554,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HNFOZXOCLKEAOY-LZRIJZTESA-N,"InChI=1S/C41H51NO18/c1-12-18(2)35(48)59-34-30(55-23(7)45)32-39(11,51)41-31(56-24(8)46)27(29(54-22(6)44)33(57-25(9)47)40(34,41)17-52-21(5)43)38(10,60-41)16-53-37(50)26-14-13-15-42-28(26)19(3)20(4)36(49)58-32/h12-15,19-20,27,29-34,51H,16-17H2,1-11H3/b18-12+/t19-,20-,27-,29-,30-,31-,32-,33-,34+,38+,39+,40-,41+/m1/s1",C/C=C(\C)C(=O)O[C@H]1[C@H](OC(C)=O)[C@H]2OC(=O)[C@H](C)[C@@H](C)c3ncccc3C(=O)OC[C@]3(C)O[C@@]4([C@H](OC(C)=O)[C@H]3[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@]14COC(C)=O)[C@@]2(C)O,C41H51NO18,pos_1_minus1proton2sodium,845.310613792,HNFOZXOCLKEAOY,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,3,7.5 1178,6553,539,,,,0.6601598,ISDB,,,,,,,ZJWICVPGFNAAKI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.640639305114746 1179,6552,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,MKBQPQRKKGIVKB-WRUJPEORSA-N,"InChI=1S/C38H47NO18/c1-17-26(46)13-12-25-24(11-10-14-39-25)34(47)50-15-35(8)27-28(52-19(3)41)32(55-22(6)44)37(16-49-18(2)40)33(56-23(7)45)29(53-20(4)42)31(51-17)36(9,48)38(37,57-35)30(27)54-21(5)43/h10-11,14,17,27-33,48H,12-13,15-16H2,1-9H3/t17-,27+,28+,29-,30+,31-,32+,33-,35-,36+,37+,38-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1CCC(=O)[C@H](C)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@@]4(C)O,C38H47NO18,pos_1_sodium,805.279313664,MKBQPQRKKGIVKB,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 1180,6549,-1,,,,0.48531187,ISDB,,,,,,,YQOAGQXZERPGOO,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.9412474632263184 1181,6547,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HNFOZXOCLKEAOY-LZRIJZTESA-N,"InChI=1S/C41H51NO18/c1-12-18(2)35(48)59-34-30(55-23(7)45)32-39(11,51)41-31(56-24(8)46)27(29(54-22(6)44)33(57-25(9)47)40(34,41)17-52-21(5)43)38(10,60-41)16-53-37(50)26-14-13-15-42-28(26)19(3)20(4)36(49)58-32/h12-15,19-20,27,29-34,51H,16-17H2,1-11H3/b18-12+/t19-,20-,27-,29-,30-,31-,32-,33-,34+,38+,39+,40-,41+/m1/s1",C/C=C(\C)C(=O)O[C@H]1[C@H](OC(C)=O)[C@H]2OC(=O)[C@H](C)[C@@H](C)c3ncccc3C(=O)OC[C@]3(C)O[C@@]4([C@H](OC(C)=O)[C@H]3[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@]14COC(C)=O)[C@@]2(C)O,C41H51NO18,pos_1_sodium,845.310613792,HNFOZXOCLKEAOY,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,3,7.5 1182,6545,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,DHLFYSNOCHUPMP-ZIBOQDOISA-N,"InChI=1S/C34H40O16/c1-16-26(45-18(3)36)27(46-19(4)37)30(49-22(7)40)33(15-43-17(2)35)29(48-21(6)39)25(41)24-28(47-20(5)38)34(16,33)50-32(24,8)14-44-31(42)23-12-10-9-11-13-23/h9-13,16,24,26-30H,14-15H2,1-8H3/t16-,24-,26-,27+,28-,29-,30+,32+,33-,34-/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(O[C@@]3(C)COC(=O)c1ccccc1)[C@H](C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O,C34H40O16,pos_1_1proton1acetonitrile,704.2316352,DHLFYSNOCHUPMP,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,3,8.5 1183,6544,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,SGYXRITWGDMMSS-OUWJXSMFSA-N,"InChI=1S/C38H47NO17/c1-17-12-13-26-25(11-10-14-39-26)35(47)49-15-36(9)27-29(50-20(4)41)32(53-23(7)44)37(16-48-19(3)40)33(54-24(8)45)30(51-21(5)42)28(55-34(17)46)18(2)38(37,56-36)31(27)52-22(6)43/h10-11,14,17-18,27-33H,12-13,15-16H2,1-9H3/t17-,18+,27-,28-,29-,30+,31+,32+,33+,36-,37+,38-/m0/s1",CC(=O)OC[C@@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(=O)[C@@H](C)CCc4ncccc4C(=O)OC[C@]4(C)O[C@@]1([C@@H]3C)[C@H](OC(C)=O)[C@@H]4[C@H](OC(C)=O)[C@H]2OC(C)=O,C38H47NO17,pos_1_1proton,789.284399044,SGYXRITWGDMMSS,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,8.5 1184,6543,1188,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.22733282,ISDB,BOSWOPWZUWOKCS-JENPMCLXSA-N,"InChI=1S/C34H39NO11/c1-19-16-26(42-20(2)36)28(44-22(4)38)33(18-41-31(40)25-14-10-11-15-35-25)29(45-30(39)23-12-8-7-9-13-23)27(43-21(3)37)24-17-34(19,33)46-32(24,5)6/h7-15,19,24,26-29H,16-18H2,1-6H3/t19-,24-,26+,27+,28+,29-,33+,34+/m1/s1",CC(=O)O[C@H]1[C@H]2C[C@]3(OC2(C)C)[C@H](C)C[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(COC(=O)c2ccccn2)[C@@H]1OC(=O)c1ccccc1,C34H39NO11,,637.252311068,BOSWOPWZUWOKCS,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,3,8.409331262111664 1185,6542,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1186,6542,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-IZJUWVJPSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26+,27-,28+,29-,30+,33-,34+,35-,36-/m1/s1",CC(=O)OC[C@]12[C@@H](OC(C)=O)C(=O)[C@H]3[C@@H](OC(C)=O)[C@]14O[C@]3(C)COC(=O)c1cccnc1[C@H](C)[C@@H](C)C(=O)O[C@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,0,7.0 1187,6542,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 1188,6542,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,IMIAGCONYJPMDY-DYYRVMIMSA-N,"InChI=1S/C36H43NO17/c1-15-16(2)31(44)53-29-26(49-18(4)39)30(52-21(7)42)35(14-47-17(3)38)28(51-20(6)41)25(43)23-27(50-19(5)40)36(35,34(29,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,26-30,46H,13-14H2,1-9H3/t15-,16-,23+,26-,27+,28+,29-,30-,33-,34-,35+,36-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O,C36H43NO17,pos_1_1proton,761.253098916,IMIAGCONYJPMDY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1189,6542,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_1proton,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1190,6542,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,QFMYKKJPSVFBKJ-UHFFFAOYSA-N,"InChI=1S/C36H43NO17/c1-16-11-12-23-22(10-9-13-37-23)32(45)48-14-33(7)24-25(43)28(51-20(5)41)35(15-47-17(2)38)30(52-21(6)42)26(49-18(3)39)29(53-31(16)44)34(8,46)36(35,54-33)27(24)50-19(4)40/h9-10,13,16,24,26-30,46H,11-12,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O,C36H43NO17,pos_1_1proton,761.253098916,QFMYKKJPSVFBKJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Euonymus nanus,70569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanus'],7,0,7.0 1191,6541,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.38668522,ISDB,ZYSZYRLNZATAPP-UHFFFAOYSA-N,"InChI=1S/C20H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(23)24-18-19(22)17-21/h12-13,19,21-22H,2-11,14-18H2,1H3",CCCCCCCCCCCC=CCCCC(=O)OCC(O)CO,C20H38O4,,342.27700969599994,ZYSZYRLNZATAPP,Fatty acids,Glycerolipids,Monoacylglycerols,Foeniculum vulgare,498475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Foeniculum'],['Foeniculum vulgare'],4,1,6.046740889549255 1192,6539,430,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,MKBQPQRKKGIVKB-WRUJPEORSA-N,"InChI=1S/C38H47NO18/c1-17-26(46)13-12-25-24(11-10-14-39-25)34(47)50-15-35(8)27-28(52-19(3)41)32(55-22(6)44)37(16-49-18(2)40)33(56-23(7)45)29(53-20(4)42)31(51-17)36(9,48)38(37,57-35)30(27)54-21(5)43/h10-11,14,17,27-33,48H,12-13,15-16H2,1-9H3/t17-,27+,28+,29-,30+,31-,32+,33-,35-,36+,37+,38-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1CCC(=O)[C@H](C)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@@]4(C)O,C38H47NO18,pos_1_1proton,805.279313664,MKBQPQRKKGIVKB,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 1193,6538,238,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,DPKBLLFCUGWECD-GTYQNAEWSA-N,"InChI=1S/C28H46O3/c1-18-19(29)7-8-20-24(18,3)10-9-21-25(20,4)12-13-27(6)22-17-23(2,30)11-15-28(22,31)16-14-26(21,27)5/h18,20-22,30-31H,7-17H2,1-6H3/t18-,20+,21-,22-,23+,24+,25-,26+,27-,28-/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)CC[C@]3(O)CC[C@]12C,C28H46O3,pos_2MNa,430.344695332,DPKBLLFCUGWECD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,3,8.5 1194,6537,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.63969535,ISDB,INMABPVEUVMMPG-UHFFFAOYSA-N,"InChI=1S/C18H16O8/c1-6-4-10(20)7(2)14-11(6)18(24)26-16-9(5-19)13(21)12(17(22)23)8(3)15(16)25-14/h4,19-21H,5H2,1-3H3,(H,22,23)",Cc1cc(O)c(C)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H16O8,,360.084517472,INMABPVEUVMMPG,Polyketides,Aromatic polyketides,Depsidones,Relicina incongrua,3768319.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Parmeliaceae'],['Unknown'],['Relicina'],['Relicina incongrua'],1,0,3.558781385421753 1195,6537,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.63969535,ISDB,INMABPVEUVMMPG-UHFFFAOYSA-N,"InChI=1S/C18H16O8/c1-6-4-10(20)7(2)14-11(6)18(24)26-16-9(5-19)13(21)12(17(22)23)8(3)15(16)25-14/h4,19-21H,5H2,1-3H3,(H,22,23)",Cc1cc(O)c(C)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H16O8,,360.084517472,INMABPVEUVMMPG,Polyketides,Aromatic polyketides,Depsidones,Lecanora myriocarpoides,3777073.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Lecanoraceae'],['Unknown'],['Lecanora'],['Lecanora myriocarpoides'],1,0,3.558781385421753 1196,6535,-1,,,,0.0,MS1_match,GZCGUPFRVQAUEE-SLPGGIOYSA-N,"InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m0/s1",O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C6H12O6,pos_2MHCH3CN,180.063388104,GZCGUPFRVQAUEE,Carbohydrates,Saccharides,Monosaccharides,Salacia oblonga,316027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia oblonga'],6,0,6.0 1197,6535,-1,,,,0.0,MS1_match,GZCGUPFRVQAUEE-SLPGGIOYSA-N,"InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m0/s1",O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C6H12O6,pos_2MHCH3CN,180.063388104,GZCGUPFRVQAUEE,Carbohydrates,Saccharides,Monosaccharides,Salacia reticulata,5750051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia reticulata'],6,0,6.0 1198,6535,-1,,,,0.0,MS1_match,BJHIKXHVCXFQLS-UYFOZJQFSA-N,"InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5-,6-/m1/s1",O=C(CO)[C@@H](O)[C@H](O)[C@H](O)CO,C6H12O6,pos_2MHCH3CN,180.063388104,BJHIKXHVCXFQLS,Carbohydrates,Saccharides,Monosaccharides,Salacia oblonga,316027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia oblonga'],6,0,6.0 1199,6535,-1,,,,0.0,MS1_match,BJHIKXHVCXFQLS-UYFOZJQFSA-N,"InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5-,6-/m1/s1",O=C(CO)[C@@H](O)[C@H](O)[C@H](O)CO,C6H12O6,pos_2MHCH3CN,180.063388104,BJHIKXHVCXFQLS,Carbohydrates,Saccharides,Monosaccharides,Salacia reticulata,5750051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia reticulata'],6,0,6.0 1200,6535,-1,,,,0.0,MS1_match,WQZGKKKJIJFFOK-GASJEMHNSA-N,"InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1",OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C6H12O6,pos_2MHCH3CN,180.063388104,WQZGKKKJIJFFOK,Carbohydrates,Saccharides,Disaccharides,Salacia oblonga,316027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia oblonga'],6,0,6.0 1201,6535,-1,,,,0.0,MS1_match,WQZGKKKJIJFFOK-GASJEMHNSA-N,"InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1",OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C6H12O6,pos_2MHCH3CN,180.063388104,WQZGKKKJIJFFOK,Carbohydrates,Saccharides,Disaccharides,Salacia reticulata,5750051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia reticulata'],6,0,6.0 1202,6535,-1,,,,0.0,MS1_match,CDAISMWEOUEBRE-GPIVLXJGSA-N,"InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-",O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O,C6H12O6,pos_2MHCH3CN,180.063388104,CDAISMWEOUEBRE,Carbohydrates,Polyols,Cyclitols,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1203,6535,-1,,,,0.0,MS1_match,LKDRXBCSQODPBY-VRPWFDPXSA-N,"InChI=1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4-,5+,6?/m1/s1",OCC1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O,C6H12O6,pos_2MHCH3CN,180.063388104,LKDRXBCSQODPBY,Carbohydrates,Saccharides,Monosaccharides,Salacia oblonga,316027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia oblonga'],6,0,6.0 1204,6535,-1,,,,0.0,MS1_match,LKDRXBCSQODPBY-VRPWFDPXSA-N,"InChI=1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4-,5+,6?/m1/s1",OCC1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O,C6H12O6,pos_2MHCH3CN,180.063388104,LKDRXBCSQODPBY,Carbohydrates,Saccharides,Monosaccharides,Salacia reticulata,5750051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia reticulata'],6,0,6.0 1205,6533,1188,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.28184167,ISDB,LISHAQDJMDPPOF-TVUKNPRMSA-N,"InChI=1S/C34H39NO12/c1-19(36)42-18-33-24(43-20(2)37)14-15-32(6,41)34(33)27(44-21(3)38)25(31(4,5)47-34)26(45-29(39)22-11-8-7-9-12-22)28(33)46-30(40)23-13-10-16-35-17-23/h7-13,16-17,24-28,41H,14-15,18H2,1-6H3/t24-,25+,26+,27+,28+,32-,33-,34-/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(C)=O)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@@H](OC(=O)c1ccccc1)[C@H]2OC(=O)c1cccnc1)[C@H]3OC(C)=O,C34H39NO12,,653.247225688,LISHAQDJMDPPOF,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,8.627366662025452 1206,6528,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.3185921,ISDB,YJMNEZANCYQLJR-RXRZWOQSSA-N,"InChI=1S/C30H26O13/c31-12-6-17(35)23-22(7-12)42-29(10-1-2-14(32)16(34)3-10)27(41)25(23)24-18(36)9-15(33)13-8-21(39)28(43-30(13)24)11-4-19(37)26(40)20(38)5-11/h1-7,9,21,25,27-29,31-41H,8H2/t21-,25?,27-,28-,29-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C30H26O13,,594.137340892,YJMNEZANCYQLJR,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,3,8.774368405342102 1207,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1208,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1209,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1210,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1211,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 1212,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1213,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1214,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1215,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 1216,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 1217,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1218,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1219,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1220,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 1221,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 1222,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1223,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1224,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 1225,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1226,6526,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 1227,6525,137,Alkaloids,Lysine alkaloids,Polyamines,0.0,MS1_match,XNQNGMLBSCADES-RWWGKFEVSA-N,"InChI=1S/C19H33N3O2/c1-3-4-5-6-7-11-18-16-19(24)21-13-10-15-22(17(2)23)14-9-8-12-20-18/h4-5,7,11,18,20H,3,6,8-10,12-16H2,1-2H3,(H,21,24)/b5-4-,11-7-/t18-/m0/s1",CC/C=C\C/C=C\[C@H]1CC(=O)NCCCN(C(C)=O)CCCCN1,C19H33N3O2,pos_1_1proton,335.257277296,XNQNGMLBSCADES,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Monteverdia loeseneri,5750134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia loeseneri'],6,2,7.0 1228,6523,314,Terpenoids,Monoterpenoids,Lactones,0.35863766,ISDB,MPYYVGIJHREDBO-SLEUVZQESA-N,"InChI=1S/C15H26O2/c1-10(2)8-13(16)17-12-9-11-6-7-15(12,5)14(11,3)4/h10-12H,6-9H2,1-5H3/t11-,12-,15+/m0/s1",CC(C)CC(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C15H26O2,,238.193280072,MPYYVGIJHREDBO,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.434550642967224 1229,6522,-1,,,,0.653333,ISDB,TVHXKPMFCYEQTM-SGTUEMJUSA-N,"InChI=1S/C18H30O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h4-5,8,11,16-17H,2-3,6-7,9-10,12-15H2,1H3,(H,19,20)/b5-4-,11-8-/t16-,17-/m1/s1",CCCCC[C@H]1O[C@@H]1C/C=C\C/C=C\CCCCC(=O)O,C18H30O3,,294.21949482,TVHXKPMFCYEQTM,Fatty acids,Fatty Acids and Conjugates,Epoxy fatty acids,Colocasia antiquorum,905242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Araceae'],['Colocasieae'],['Colocasia'],['Colocasia antiquorum'],4,0,6.613332033157349 1230,6522,-1,,,,0.653333,ISDB,TVHXKPMFCYEQTM-SGTUEMJUSA-N,"InChI=1S/C18H30O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h4-5,8,11,16-17H,2-3,6-7,9-10,12-15H2,1H3,(H,19,20)/b5-4-,11-8-/t16-,17-/m1/s1",CCCCC[C@H]1O[C@@H]1C/C=C\C/C=C\CCCCC(=O)O,C18H30O3,,294.21949482,TVHXKPMFCYEQTM,Fatty acids,Fatty Acids and Conjugates,Epoxy fatty acids,Colocasia esculenta,1008203.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Araceae'],['Colocasieae'],['Colocasia'],['Colocasia esculenta'],4,0,6.613332033157349 1231,6518,-1,,,,0.4260991,ISDB,XLKOZYOVXNPWGT-UHFFFAOYSA-N,"InChI=1S/C14H26O3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h2-12H2,1H3,(H,16,17)",CCCCCCCCCCCC(=O)CC(=O)O,C14H26O3,,242.188194692,XLKOZYOVXNPWGT,Fatty acids,Fatty Acids and Conjugates,Oxo fatty acids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,5.704396367073059 1232,6517,-1,,,,0.5745165,ISDB,,,,,,,VQQDSKQZMSNFHR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.2980659008026123 1233,6516,676,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HEYZWPRKKUGDCR-QBXMEVCASA-N,"InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@]21O,C16H22O10,pos_1_1proton1acetonitrile,374.1212969039999,HEYZWPRKKUGDCR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1234,6516,676,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HEYZWPRKKUGDCR-QBXMEVCASA-N,"InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@]21O,C16H22O10,pos_1_1proton1acetonitrile,374.1212969039999,HEYZWPRKKUGDCR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1235,6516,676,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,PUEUIRDVQIKCCG-GMHYLCIRSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)/t7?,8?,10-,11-,12+,13-,15+,16+/m1/s1",C=CC1C(CC=O)C(C(=O)O)=CO[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O10,pos_1_1proton1acetonitrile,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1236,6516,676,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_1proton1acetonitrile,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 1237,6516,676,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,PUEUIRDVQIKCCG-GMHYLCIRSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)/t7?,8?,10-,11-,12+,13-,15+,16+/m1/s1",C=CC1C(CC=O)C(C(=O)O)=CO[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O10,pos_1_1proton1acetonitrile,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 1238,6516,676,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_1proton1acetonitrile,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 1239,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 1240,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UHFFFAOYSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)",O=C(C=Cc1ccc(O)c(O)c1)OC(C(=O)O)C(O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.084911396,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 1241,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1242,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 1243,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 1244,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 1245,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,0,6.0 1246,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1247,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 1248,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UHFFFAOYSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)",O=C(C=Cc1ccc(O)c(O)c1)OC(C(=O)O)C(O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.084911396,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 1249,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1250,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 1251,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 1252,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 1253,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,0,6.0 1254,6515,-1,,,,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_sodium,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1255,6513,-1,,,,0.0,MS1_match,OKJADYKTJJGKDX-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-3-5-7-9(10)11-8-6-4-2/h3-8H2,1-2H3",CCCCOC(=O)CCCC,C9H18O2,pos_2MH,158.130679816,OKJADYKTJJGKDX,Fatty acids,Fatty esters,Wax monoesters,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1256,6513,-1,,,,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MH,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1257,6513,-1,,,,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MH,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1258,6513,-1,,,,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MH,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1259,6513,-1,,,,0.0,MS1_match,ADNADZOSMJDVIS-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-4-5-6-9(10)11-7-8(2)3/h8H,4-7H2,1-3H3",CCCCC(=O)OCC(C)C,C9H18O2,pos_2MH,158.130679816,ADNADZOSMJDVIS,Fatty acids,Fatty esters,Wax monoesters,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1260,6513,-1,,,,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MH,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1261,6511,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.6008169,ISDB,UZYQOQVQVNHEEQ-LEHJWURJSA-N,"InChI=1S/C14H24O2/c1-4-14(3,16)11-9-7-5-6-8-10-13(2)12-15/h4-5,7,10,15-16H,1,6,8-9,11-12H2,2-3H3/b7-5+,13-10+/t14-/m1/s1",C=C[C@@](C)(O)CC/C=C/CC/C=C(\C)CO,C14H24O2,,224.177630008,UZYQOQVQVNHEEQ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Ursinia alpina,7597283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Ursinia'],['Ursinia alpina'],4,1,6.9032676219940186 1262,6511,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.6008169,ISDB,UZYQOQVQVNHEEQ-BAUODEKUSA-N,"InChI=1S/C14H24O2/c1-4-14(3,16)11-9-7-5-6-8-10-13(2)12-15/h4-5,7,10,15-16H,1,6,8-9,11-12H2,2-3H3/b7-5+,13-10-/t14-/m1/s1",C=C[C@@](C)(O)CC/C=C/CC/C=C(/C)CO,C14H24O2,,224.177630008,UZYQOQVQVNHEEQ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Ursinia anethoides,7597284.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Ursinia'],['Ursinia anethoides'],4,1,6.9032676219940186 1263,6510,656,,,,0.5748807,ISDB,XBIPNCBYIRUADC-GRIDYHOASA-N,"InChI=1S/C50H88N8O12/c1-27(2)18-16-14-13-15-17-19-33-25-40(60)52-34(20-21-39(51)59)44(63)53-35(22-28(3)4)45(64)54-36(23-29(5)6)47(66)57-42(31(9)10)49(68)56-38(26-41(61)62)46(65)55-37(24-30(7)8)48(67)58-43(32(11)12)50(69)70-33/h27-38,42-43H,13-26H2,1-12H3,(H2,51,59)(H,52,60)(H,53,63)(H,54,64)(H,55,65)(H,56,68)(H,57,66)(H,58,67)(H,61,62)/t33-,34+,35+,36-,37+,38+,42+,43+/m1/s1",CC(C)CCCCCCC[C@@H]1CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)O1,C50H88N8O12,,992.652170256,XBIPNCBYIRUADC,,,,Bacillus licheniformis,37595.0,['Bacteria'],['Unknown'],['Firmicutes'],['Bacilli'],['Bacillales'],['Bacillaceae'],['Unknown'],['Bacillus'],['Bacillus licheniformis'],0,0,2.299522876739502 1264,6508,80,Terpenoids,Steroids,Spirostane steroids,0.5214306,ISDB,WEHSXCOPWFFJPK-FUPJEDBSSA-N,"InChI=1S/C35H58O11/c1-19-30(38)26(42-6)17-29(43-19)46-31-20(2)44-28(16-25(31)36)45-22-9-11-32(3)21(15-22)7-8-24-23(32)10-12-33(4)34(24,39)13-14-35(33,40)27(37)18-41-5/h7,19-20,22-31,36-40H,8-18H2,1-6H3/t19-,20-,22+,23+,24-,25+,26+,27+,28+,29+,30-,31-,32+,33+,34+,35-/m1/s1",COC[C@H](O)[C@]1(O)CC[C@]2(O)[C@@H]3CC=C4C[C@@H](O[C@H]5C[C@H](O)[C@H](O[C@H]6C[C@H](OC)[C@H](O)[C@@H](C)O6)[C@@H](C)O5)CC[C@]4(C)[C@H]3CC[C@]12C,C35H58O11,,654.397912676,WEHSXCOPWFFJPK,Terpenoids,Steroids,Pregnane steroids,Periploca sepium,780215.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Unknown'],['Periploca'],['Periploca sepium'],4,2,7.08572244644165 1265,6507,-1,,,,0.0,MS1_match,DRAPQDCEBKBPQE-ACFZRETJSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(13-4-6-16(29)18(8-13)34-2)26(14,11-36-23)38-25-22(32)21(31)20(30)19(9-27)37-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25+,26-/m1/s1",COc1cc([C@H]2OC[C@]3(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639999,DRAPQDCEBKBPQE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1266,6507,-1,,,,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1267,6507,-1,,,,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1268,6507,-1,,,,0.0,MS1_match,GQLQVPZSTWXDBQ-ZOKOZUFBSA-N,"InChI=1S/C26H32O12/c1-33-17-8-13(3-5-15(17)28)24-26(32)11-36-23(14(26)10-35-24)12-4-6-16(18(7-12)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25-,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639998,GQLQVPZSTWXDBQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 1269,6507,-1,,,,0.0,MS1_match,KPZWNZOLVDRTMM-YRDWWIAGSA-N,"InChI=1S/C26H32O12/c1-33-18-8-13(3-5-16(18)28)23-26(32)11-36-22(15(26)10-35-23)12-4-6-17(19(7-12)34-2)37-25-14(9-27)20(29)21(30)24(31)38-25/h3-8,14-15,20-25,27-32H,9-11H2,1-2H3/t14-,15-,20-,21+,22-,23-,24+,25+,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@H]5O[C@H](O)[C@@H](O)[C@H](O)[C@H]5CO)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,KPZWNZOLVDRTMM,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 1270,6505,-1,,,,0.0,MS1_match,XQYXXQQJMLGSBS-UHFFFAOYSA-O,"InChI=1S/C20H25NO3/c1-21(2)10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/p+1",COc1cc2c(cc1OC)C(Cc1ccc(O)cc1)[N+](C)(C)CC2,C20H26NO3+,pos_1_sodium,328.19072011209,XQYXXQQJMLGSBS,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum revolutum,421843.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum revolutum'],6,0,6.0 1271,6505,-1,,,,0.0,MS1_match,XQYXXQQJMLGSBS-GOSISDBHSA-O,"InChI=1S/C20H25NO3/c1-21(2)10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/p+1/t18-/m1/s1",COc1cc2c(cc1OC)[C@@H](Cc1ccc(O)cc1)[N+](C)(C)CC2,C20H26NO3+,pos_1_sodium,328.19072011209,XQYXXQQJMLGSBS,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 1272,6503,-1,,,,0.36771238,ISDB,DUYJLWRTVAWXTP-ODSQUGJNSA-N,"InChI=1S/C26H38O10/c1-11-12-7-13(28)20-24(2)5-4-6-25(3,15(24)8-16(29)26(20,9-12)21(11)33)23(34)36-22-19(32)18(31)17(30)14(10-27)35-22/h12-20,22,27-32H,1,4-10H2,2-3H3/t12-,13+,14-,15+,16-,17-,18+,19-,20+,22+,24-,25-,26+/m1/s1",C=C1C(=O)[C@]23C[C@H]1C[C@H](O)[C@H]2[C@]1(C)CCC[C@@](C)(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1C[C@H]3O,C26H38O10,,510.246497416,DUYJLWRTVAWXTP,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Hyalis argentea,317671.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Hyalideae'],['Hyalis'],['Hyalis argentea'],4,0,5.470849514007568 1273,6501,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.61362255,ISDB,LQUHZVLTTWMBTO-UHFFFAOYSA-N,"InChI=1S/C18H34O3/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-2,19H,3-17H2,(H,20,21)",O=C(O)CCCCCCCC=CCCCCCCCCO,C18H34O3,,298.250794948,LQUHZVLTTWMBTO,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.9544901847839355 1274,6499,-1,,,,0.0,MS1_match,GSNDZNARAOJCNA-OFJSOFFBSA-N,"InChI=1S/C23H29NO3/c1-13-18-6-7-19-17-5-4-15-10-16(26)8-9-22(15,3)21(17)20(27-14(2)25)11-23(18,19)12-24-13/h8-10,17,19-21,24H,4-7,11-12H2,1-3H3/t17?,19?,20-,21-,22?,23?/m1/s1",CC(=O)O[C@@H]1CC23CNC(C)=C2CCC3C2CCC3=CC(=O)C=CC3(C)[C@H]21,C23H29NO3,pos_2MK,367.214743788,GSNDZNARAOJCNA,Terpenoids,,,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 1275,6498,698,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.0,MS1_match,USNYNNITUQSEEV-UHFFFAOYSA-N,"InChI=1S/C32H54O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-36-32(34)26-24-29-23-25-30(33)31(28-29)35-2/h23-26,28,33H,3-22,27H2,1-2H3",CCCCCCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(OC)c1,C32H54O4,pos_1_1proton1ammonium,502.4022102079999,USNYNNITUQSEEV,,,,Reissantia buchananii,380816.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Reissantia'],['Reissantia buchananii'],6,0,6.0 1276,6498,698,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.0,MS1_match,USNYNNITUQSEEV-UHFFFAOYSA-N,"InChI=1S/C32H54O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-36-32(34)26-24-29-23-25-30(33)31(28-29)35-2/h23-26,28,33H,3-22,27H2,1-2H3",CCCCCCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(OC)c1,C32H54O4,pos_1_1proton1ammonium,502.4022102079999,USNYNNITUQSEEV,,,,Reissantia buchananii,380816.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Reissantia'],['Reissantia buchananii'],6,0,6.0 1277,6496,403,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.5555237,ISDB,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,2,9.222094774246216 1278,6496,403,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.5555237,ISDB,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,2,9.222094774246216 1279,6496,403,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.5555237,ISDB,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,2,9.222094774246216 1280,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 1281,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 1282,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1283,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1284,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 1285,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 1286,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 1287,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1288,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1289,6494,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 1290,6491,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.64604867,ISDB,KLQOLSXBHGJGJD-UHFFFAOYSA-N,"InChI=1S/C36H42O10/c1-14(12-37)7-25(38)45-13-35(43)22-10-21(22)33(4)23(35)11-19-15(2)32(42)46-36(19)24(33)9-18-17-8-20(17)34(5)27(18)28(36)26(29(39)30(34)40)16(3)31(41)44-6/h7,17,20-24,28,30,37,40,43H,8-13H2,1-6H3",COC(=O)C(C)=C1C(=O)C(O)C2(C)C3=C(CC4C5(OC(=O)C(C)=C5CC5C(O)(COC(=O)C=C(C)CO)C6CC6C54C)C13)C1CC12,C36H42O10,,634.277797544,KLQOLSXBHGJGJD,Terpenoids,Sesquiterpenoids,Cycloeudesmane sesquiterpenoids,Chloranthus fortunei,569911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Chloranthales'],['Chloranthaceae'],['Unknown'],['Chloranthus'],['Chloranthus fortunei'],4,2,7.584194660186768 1291,6484,383,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.45248938,ISDB,NYLNHNDMNOPWAZ-ZLEFDVGRSA-N,"InChI=1S/C19H32O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h7,11,13-18,20,22-24H,5-6,8-9H2,1-4H3/t11-,13+,14-,15-,16+,17-,18-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1CC[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O7,,372.2148033639999,NYLNHNDMNOPWAZ,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Epimedium grandiflorum,655264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium grandiflorum'],5,3,8.309957504272461 1292,6484,383,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.45248938,ISDB,NYLNHNDMNOPWAZ-MLONCLLVSA-N,"InChI=1S/C19H32O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h7,11,13-18,20,22-24H,5-6,8-9H2,1-4H3/t11-,13-,14-,15-,16+,17-,18-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@H]1CC[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O7,,372.2148033639999,NYLNHNDMNOPWAZ,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Epimedium sagittatum,175143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium sagittatum'],5,3,8.309957504272461 1293,6483,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.39174253,ISDB,UTGHYWBAVNHHJG-DKBPJWHKSA-N,"InChI=1S/C25H40O7S/c1-17-10-11-20-21(9-6-13-24(20,2)3)25(17,4)14-12-18(16-31-33(28,29)30)7-5-8-19-15-22(26)32-23(19)27/h9,15,17-18,20,23,27H,5-8,10-14,16H2,1-4H3,(H,28,29,30)/t17-,18+,20-,23+,25-/m0/s1",C[C@H]1CC[C@H]2C(=CCCC2(C)C)[C@@]1(C)CC[C@@H](CCCC1=CC(=O)O[C@H]1O)COS(=O)(=O)O,C25H40O7S,,484.24947462,UTGHYWBAVNHHJG,Terpenoids,Diterpenoids,Halimane diterpenoids,Fasciospongia,379311.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Dictyoceratida'],['Thorectidae'],['Unknown'],['Fasciospongia'],['Unknown'],1,1,3.066970109939575 1294,6480,-1,,,,0.0,MS1_match,GKIYZDZSEWNEIQ-IKLCLHKNSA-N,"InChI=1S/C32H45NO9/c1-6-33-16-28(17-38-2)12-11-22(40-4)32-20-13-30(36)23(41-5)15-29(35,21(25(32)33)14-31(28,32)37)24(20)26(30)42-27(34)18-7-9-19(39-3)10-8-18/h7-10,20-26,35-37H,6,11-17H2,1-5H3/t20-,21+,22+,23+,24-,25-,26-,28+,29+,30+,31+,32-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](O)([C@H]5[C@H]6OC(=O)c5ccc(OC)cc5)[C@@H](C[C@]23O)[C@@H]14,C32H45NO9,pos_1_1proton1methanol,587.30943202,GKIYZDZSEWNEIQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,0,6.0 1295,6480,-1,,,,0.0,MS1_match,WCJLKJORIRSXRT-QJPGOXMJSA-N,"InChI=1S/C32H45NO9/c1-6-33-15-29(16-38-2)19(34)12-20(39-3)32-18-13-30(36)21(40-4)14-31(37,23(26(32)33)24(41-5)25(29)32)22(18)27(30)42-28(35)17-10-8-7-9-11-17/h7-11,18-27,34,36-37H,6,12-16H2,1-5H3/t18-,19-,20+,21+,22-,23+,24+,25-,26-,27-,29+,30+,31-,32+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](O)([C@H]5[C@H]6OC(=O)c5ccccc5)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C32H45NO9,pos_1_1proton1methanol,587.30943202,WCJLKJORIRSXRT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 1296,6480,-1,,,,0.0,MS1_match,WCJLKJORIRSXRT-QJPGOXMJSA-N,"InChI=1S/C32H45NO9/c1-6-33-15-29(16-38-2)19(34)12-20(39-3)32-18-13-30(36)21(40-4)14-31(37,23(26(32)33)24(41-5)25(29)32)22(18)27(30)42-28(35)17-10-8-7-9-11-17/h7-11,18-27,34,36-37H,6,12-16H2,1-5H3/t18-,19-,20+,21+,22-,23+,24+,25-,26-,27-,29+,30+,31-,32+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](O)([C@H]5[C@H]6OC(=O)c5ccccc5)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C32H45NO9,pos_1_1proton1methanol,587.30943202,WCJLKJORIRSXRT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,0,6.0 1297,6480,-1,,,,0.0,MS1_match,ASRBVBIKKAZQBW-WUIPJRSZSA-N,"InChI=1S/C32H45NO9/c1-6-33-15-29(16-38-2)21-11-19-26(33)32(21,23(40-4)12-22(29)34)20-13-31(37)24(41-5)14-30(19,36)25(20)27(31)42-28(35)17-7-9-18(39-3)10-8-17/h7-10,19-27,34,36-37H,6,11-16H2,1-5H3/t19-,20-,21+,22-,23-,24+,25-,26+,27+,29+,30+,31+,32+/m1/s1",CCN1C[C@@]2(COC)[C@H](O)C[C@@H](OC)[C@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](O)([C@H]5[C@@H]6OC(=O)c5ccc(OC)cc5)[C@H](C[C@@H]23)[C@H]14,C32H45NO9,pos_1_1proton1methanol,587.30943202,ASRBVBIKKAZQBW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,0,6.0 1298,6480,-1,,,,0.0,MS1_match,YUGVPMDSXOGQHN-NRBKXCDDSA-N,"InChI=1S/C32H45NO9/c1-7-33-27-23-24(35)26-30(2,29(33)41-6)11-10-21(34)32(26,27)17-13-16-20(40-5)14-31(23,37)22(17)25(16)42-28(36)15-8-9-18(38-3)19(12-15)39-4/h8-9,12,16-17,20-27,29,34-35,37H,7,10-11,13-14H2,1-6H3/t16-,17-,20+,21+,22-,23+,24+,25+,26-,27-,29+,30-,31-,32+/m1/s1",CCN1[C@@H](OC)[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)c7ccc(OC)c(OC)c7)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C32H45NO9,pos_1_1proton1methanol,587.3094320199999,YUGVPMDSXOGQHN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,0,6.0 1299,6478,-1,,,,0.4789665,ISDB,ZLVUKTCVZMRXFB-NRXGSXMXSA-N,"InChI=1S/C19H21NO6/c1-24-14-7-11-12(8-15(14)25-2)19-9-16(26-3)13(21)6-10(19)4-5-20(19)18(23)17(11)22/h6-8,13,16,21H,4-5,9H2,1-3H3/t13-,16-,19+/m1/s1",COc1cc2c(cc1OC)[C@]13C[C@@H](OC)[C@H](O)C=C1CCN3C(=O)C2=O,C19H21NO6,,359.13688739199995,ZLVUKTCVZMRXFB,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Erythrina subumbrans,80721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Erythrina'],['Erythrina subumbrans'],0,0,1.9158660173416138 1300,6474,-1,,,,0.0,MS1_match,UTNHBQHELZUVMJ-GFFQCQNISA-N,"InChI=1S/C19H34O8/c1-10-6-12(7-19(2,3)13(10)5-4-11(22)8-20)26-18-17(25)16(24)15(23)14(9-21)27-18/h4-5,10-18,20-25H,6-9H2,1-3H3/b5-4+/t10-,11-,12+,13+,14-,15-,16+,17-,18-/m1/s1",C[C@@H]1C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@H]1/C=C/[C@@H](O)CO,C19H34O8,pos_1_1proton1acetonitrile,390.22536804799984,UTNHBQHELZUVMJ,Terpenoids,Apocarotenoids,Megastigmanes,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1301,6469,-1,,,,0.0,MS1_match,CBIQGHYKUKDTIF-DBOWSLRKSA-N,"InChI=1S/C52H78O25/c1-20-14-70-52(43(63)35(20)59)29(15-66-22(3)54)34-32(77-52)13-28-26-8-7-24-11-25(56)12-33(50(24,6)27(26)9-10-49(28,34)5)73-47-42(40(31(58)17-68-47)74-45-37(61)36(60)30(57)16-67-45)76-46-38(62)41(39(21(2)71-46)72-23(4)55)75-48-44(64)51(65,18-53)19-69-48/h7,21,25-48,53,56-65H,1,8-19H2,2-6H3/t21-,25+,26+,27-,28-,29-,30+,31-,32-,33+,34-,35-,36-,37+,38+,39-,40-,41-,42+,43-,44-,45-,46-,47-,48-,49-,50-,51+,52-/m0/s1",C=C1CO[C@@]2(O[C@H]3C[C@H]4[C@@H]5CC=C6C[C@@H](O)C[C@@H](O[C@@H]7OC[C@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]7O[C@@H](C)[C@H](OC(C)=O)[C@@H](O[C@@H]8OC[C@](O)(CO)[C@H]8O)[C@H]7O)[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2COC(C)=O)[C@@H](O)[C@H]1O,C52H78O25,pos_2_2proton2acetonitrile,1102.483217996,CBIQGHYKUKDTIF,Terpenoids,Steroids,Spirostane steroids,Helleborus orientalis,648046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus orientalis'],6,0,6.0 1302,6468,-1,,,,0.0,MS1_match,LSFCBUIGYCTVGI-UHFFFAOYSA-N,"InChI=1S/C26H28O14/c1-9-17(30)20(33)22(35)26(37-9)39-15-8-36-25(21(34)18(15)31)40-24-19(32)16-13(29)6-12(28)7-14(16)38-23(24)10-2-4-11(27)5-3-10/h2-7,9,15,17-18,20-22,25-31,33-35H,8H2,1H3",CC1OC(OC2COC(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)C(O)C2O)C(O)C(O)C1O,C26H28O14,pos_1_sodium,564.147905576,LSFCBUIGYCTVGI,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 1303,6465,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_minus1proton2sodium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,1,8.5 1304,6465,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_minus1proton2sodium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,1,8.5 1305,6465,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_minus1proton2sodium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,1,8.5 1306,6465,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_minus1proton2sodium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,1,8.5 1307,6465,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_minus1proton2sodium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,1,8.5 1308,6465,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_minus1proton2sodium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,1,8.5 1309,6459,-1,,,,0.21720374,ISDB,,,,,,,QFBAQFWJRPENHZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8688149452209473 1310,6458,-1,,,,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1proton1acetonitrile,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 1311,6458,-1,,,,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1proton1acetonitrile,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 1312,6458,-1,,,,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_1proton1acetonitrile,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 1313,6458,-1,,,,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_1proton1acetonitrile,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 1314,6458,-1,,,,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_1proton1acetonitrile,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 1315,6458,-1,,,,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1proton1acetonitrile,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 1316,6457,247,,,,0.5306867,ISDB,,,,,,,OUCPDSRDBUTGPQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.122746706008911 1317,6452,903,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.36571804,ISDB,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,9.96287214756012 1318,6450,306,Amino acids and Peptides,Small peptides,Dipeptides,0.57005715,ISDB,HWMGTNOVUDIKRE-UWVGGRQHSA-N,"InChI=1S/C13H16N2O5/c14-9(6-8-4-2-1-3-5-8)12(18)15-10(13(19)20)7-11(16)17/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)/t9-,10-/m0/s1",N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,C13H16N2O5,,280.105921612,HWMGTNOVUDIKRE,Amino acids and Peptides,Small peptides,Dipeptides,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,3,7.780228614807129 1319,6449,-1,,,,0.6984941,ISDB,BQVUABVGYYSDCJ-ZFWWWQNUSA-N,"InChI=1S/C17H23N3O3/c1-10(2)7-13(18)16(21)20-15(17(22)23)8-11-9-19-14-6-4-3-5-12(11)14/h3-6,9-10,13,15,19H,7-8,18H2,1-2H3,(H,20,21)(H,22,23)/t13-,15-/m0/s1",CC(C)C[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,C17H23N3O3,,317.173941596,BQVUABVGYYSDCJ,Amino acids and Peptides,Small peptides,Dipeptides,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,0,3.793976306915283 1320,6448,784,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,0.45544448,ISDB,KQWFKXIAVOXCLU-UHFFFAOYSA-N,"InChI=1S/C22H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(25)19(23)17(2)20(24)22(18)26/h6-7,23,26H,3-5,8-16H2,1-2H3",CCCCC=CCCCCCCCCCC1=C(O)C(=O)C(C)=C(O)C1=O,C22H34O4,,362.245709568,KQWFKXIAVOXCLU,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,Maesa lanceolata,607844.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Maesa'],['Maesa lanceolata'],4,3,7.321777939796448 1321,6442,-1,,,,0.38338846,ISDB,AIENSZLGKYKXFJ-HFIMOBQHSA-N,"InChI=1S/C20H24N2O3/c1-3-12(11-23)13-8-18-20-15(6-7-21(18)2)16-10-14(24)4-5-17(16)22(20)19(25)9-13/h3-5,10-11,13,18-19,24-25H,6-9H2,1-2H3/b12-3+/t13-,18+,19+/m1/s1",C/C=C(\C=O)[C@@H]1C[C@H]2c3c(c4cc(O)ccc4n3[C@@H](O)C1)CCN2C,C20H24N2O3,,340.178692628,AIENSZLGKYKXFJ,Alkaloids,Tryptophan alkaloids,Corynanthe type,Strychnos decussata,282063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Loganiaceae'],['Unknown'],['Strychnos'],['Strychnos decussata'],4,0,5.533553838729858 1322,6442,-1,,,,0.38338846,ISDB,AIENSZLGKYKXFJ-BASWHVEKSA-N,"InChI=1S/C20H24N2O3/c1-3-12(11-23)13-8-18-20-15(6-7-21(18)2)16-10-14(24)4-5-17(16)22(20)19(25)9-13/h3-5,10-11,13,18-19,24-25H,6-9H2,1-2H3/b12-3-",C/C=C(/C=O)C1CC2c3c(c4cc(O)ccc4n3C(O)C1)CCN2C,C20H24N2O3,,340.178692628,AIENSZLGKYKXFJ,Alkaloids,Tryptophan alkaloids,Corynanthe type,Strychnos spinosa,164458.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Loganiaceae'],['Unknown'],['Strychnos'],['Strychnos spinosa'],4,0,5.533553838729858 1323,6439,-1,,,,0.47197345,ISDB,,,,,,,GAGCLMASQHYWNP,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.887893795967102 1324,6437,597,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_sodium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,3,9.5 1325,6435,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.2734341,ISDB,CUWDQBAYWDKQOB-FWDRAHGSSA-N,"InChI=1S/C30H37NO8/c1-14-11-19-22(23(14)34)24(35)17(13-32)12-20-25-28(4,5)30(25,39-16(3)33)26(15(2)29(19,20)37)38-27(36)18-9-7-8-10-21(18)31-6/h7-12,15,19-20,22,24-26,31-32,35,37H,13H2,1-6H3/t15-,19+,20+,22+,24-,25-,26-,29+,30-/m1/s1",CNc1ccccc1C(=O)O[C@@H]1[C@@H](C)[C@]2(O)[C@H]3C=C(C)C(=O)[C@H]3[C@H](O)C(CO)=C[C@H]2[C@@H]2C(C)(C)[C@]12OC(C)=O,C30H37NO8,,539.251917144,CUWDQBAYWDKQOB,Terpenoids,Diterpenoids,Tetracyclic diterpenoids,Shirakiopsis indica,3914924.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Unknown'],['Shirakiopsis'],['Shirakiopsis indica'],4,0,5.093736410140991 1326,6433,-1,,,,0.0,MS1_match,PJIVLFIKRZQZOE-URGZVSNXSA-N,"InChI=1S/C26H33NO11/c1-3-16-17(9-8-15-6-4-10-27(12-15)11-5-7-20(29)30)18(24(34)35-2)14-36-25(16)38-26-23(33)22(32)21(31)19(13-28)37-26/h3-4,6,8-10,12,14,16-17,19,21-23,25-26,28,31-33H,1,5,7,11,13H2,2H3/b9-8+/t16-,17+,19-,21-,22+,23-,25+,26+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1ccc[n+](CCCC(=O)[O-])c1,C26H33NO11,pos_1_1proton,535.205360876,PJIVLFIKRZQZOE,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 1327,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,3,7.5 1328,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BXWPDMXKEZYVBB-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)35-6)27(31,23(26)28)22(21(24)26)36-14(2)29/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC(C)=O)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,BXWPDMXKEZYVBB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,3,7.5 1329,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BXWPDMXKEZYVBB-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)35-6)27(31,23(26)28)22(21(24)26)36-14(2)29/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC(C)=O)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,BXWPDMXKEZYVBB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum leucostomum,723178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum leucostomum'],6,3,7.5 1330,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BXWPDMXKEZYVBB-UXMWTTLKSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)35-6)27(31,23(26)28)22(21(24)26)36-14(2)29/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17-,18-,19-,20-,21-,22+,23+,24+,25-,26+,27-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](OC)[C@@]34[C@@H]1[C@@](O)([C@H](OC(C)=O)[C@@H]23)[C@]1(O)C[C@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2OC,C27H43NO8,pos_1_1proton1methanol,509.298867336,BXWPDMXKEZYVBB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 1331,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UTQKGBDSCRMUJO-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(30)26-16-10-15-17(33-4)11-25(35-6,19(16)20(15)36-14(2)29)27(31,23(26)28)22(34-5)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,UTQKGBDSCRMUJO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,3,7.5 1332,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UTQKGBDSCRMUJO-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(30)26-16-10-15-17(33-4)11-25(35-6,19(16)20(15)36-14(2)29)27(31,23(26)28)22(34-5)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,UTQKGBDSCRMUJO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii var. bonvalotii,274603.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bonvalotii'],6,3,7.5 1333,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UTQKGBDSCRMUJO-YCVNKHKDSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(30)26-16-10-15-17(33-4)11-25(35-6,19(16)20(15)36-14(2)29)27(31,23(26)28)22(34-5)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20-,21+,22+,23-,24-,25-,26-,27+/m1/s1",CCN1C[C@@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@@H](OC(C)=O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H]13)[C@@H](OC)[C@@H]24,C27H43NO8,pos_1_1proton1methanol,509.298867336,UTQKGBDSCRMUJO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,3,7.5 1334,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UTQKGBDSCRMUJO-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(30)26-16-10-15-17(33-4)11-25(35-6,19(16)20(15)36-14(2)29)27(31,23(26)28)22(34-5)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,UTQKGBDSCRMUJO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,3,7.5 1335,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,CCBDRUXJHRUQCY-UHFFFAOYSA-N,"InChI=1S/C27H43NO8/c1-6-9-28-12-24(13-33-3)8-7-18(30)26-16-10-15-17(34-4)11-25(31,19(16)20(15)36-14(2)29)27(32,23(26)28)22(35-5)21(24)26/h15-23,30-32H,6-13H2,1-5H3",CCCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC(C)=O)C(O)(C(OC)C23)C14,C27H43NO8,pos_1_1proton1methanol,509.298867336,CCBDRUXJHRUQCY,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,3,7.5 1336,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UTQKGBDSCRMUJO-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(30)26-16-10-15-17(33-4)11-25(35-6,19(16)20(15)36-14(2)29)27(31,23(26)28)22(34-5)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,UTQKGBDSCRMUJO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,3,7.5 1337,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-SFMQBYNOSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20-,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum delphiniifolium,506023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum delphiniifolium'],6,3,7.5 1338,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-GVWJOXSRSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18-,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oreophilum,224814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium oreophilum'],6,3,7.5 1339,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,3,7.5 1340,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-BXQVYPRDSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15?,16-,17+,18+,19-,20+,21-,22+,23?,24+,25-,26+,27+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)C2C[C@@H]4[C@@H]1[C@H]2OC(C)=O,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,3,7.5 1341,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-VEUWJJFUSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23?,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC(C)=O,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,3,7.5 1342,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-BXQVYPRDSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15?,16-,17+,18+,19-,20+,21-,22+,23?,24+,25-,26+,27+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)C2C[C@@H]4[C@@H]1[C@H]2OC(C)=O,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,3,7.5 1343,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BQMFTYVYHRJVMQ-BXQVYPRDSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15?,16-,17+,18+,19-,20+,21-,22+,23?,24+,25-,26+,27+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)C2C[C@@H]4[C@@H]1[C@H]2OC(C)=O,C27H43NO8,pos_1_1proton1methanol,509.298867336,BQMFTYVYHRJVMQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,7.5 1344,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UTQKGBDSCRMUJO-JJQLKCKLSA-N,"InChI=1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(30)26-16-10-15-17(33-4)11-25(35-6,19(16)20(15)36-14(2)29)27(31,23(26)28)22(34-5)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16-,17+,18+,19-,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,UTQKGBDSCRMUJO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,3,7.5 1345,6432,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QWNOCXABDPZOJQ-XSDFPVSMSA-N,"InChI=1S/C27H43NO8/c1-6-28-12-24(13-33-3)8-7-19(30)26-17-9-15-18(34-4)11-25(31,10-16(17)20(15)36-14(2)29)27(32,23(26)28)22(35-5)21(24)26/h15-23,30-32H,6-13H2,1-5H3/t15-,16-,17-,18+,19+,20+,21-,22+,23+,24+,25+,26+,27-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5C[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C27H43NO8,pos_1_1proton1methanol,509.298867336,QWNOCXABDPZOJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium leroyi,259373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium leroyi'],6,3,7.5 1346,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sanyoense,675791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sanyoense'],6,3,7.5 1347,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,3,7.5 1348,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nemorum,44343.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nemorum'],6,3,7.5 1349,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-QKNOXMJZSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13?,14?,15?,16-,17?,18?,19?,20?,21?,22-,23-,24?/m0/s1",CCN1C[C@]2(COC)CCC(OC)C34C5CC6C(O)C5[C@](O)(C[C@@H]6OC)C(CC32)C14,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,3,7.5 1350,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-NPNNQAKASA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1C(C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tanguticum,1088652.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tanguticum'],6,3,7.5 1351,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongoricum,6131511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongoricum'],6,3,7.5 1352,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nagarum,488235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nagarum'],6,3,7.5 1353,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 1354,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 1355,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 1356,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,7.5 1357,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum dolichorhynchum,6131378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum dolichorhynchum'],6,3,7.5 1358,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum legendrei,44349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum legendrei'],6,3,7.5 1359,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,3,7.5 1360,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 1361,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,3,7.5 1362,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,3,7.5 1363,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,3,7.5 1364,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,3,7.5 1365,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 1366,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,3,7.5 1367,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-YXQJRNGSSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19-,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,3,7.5 1368,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium virgatum,885406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium virgatum'],6,3,7.5 1369,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-DPMVDKOOSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15-,16-,17-,18-,19-,20+,21+,22-,23-,24-/m1/s1",CCN1C[C@@]2(C)CC[C@@H](OC)[C@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@H]([C@@H](O)[C@@H]23)[C@H]14,C24H39NO5,pos_1_1proton1methanol,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium favargeri,209870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium favargeri'],6,3,7.5 1370,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,3,7.5 1371,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 1372,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-YXQJRNGSSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19-,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,3,7.5 1373,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium virgatum,885406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium virgatum'],6,3,7.5 1374,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 1375,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-DPMVDKOOSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15-,16-,17-,18-,19-,20+,21+,22-,23-,24-/m1/s1",CCN1C[C@@]2(C)CC[C@@H](OC)[C@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@H]([C@@H](O)[C@@H]23)[C@H]14,C24H39NO5,pos_1_1proton1methanol,421.282823348,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium favargeri,209870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium favargeri'],6,3,7.5 1376,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sczukinii,7049059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sczukinii'],6,3,7.5 1377,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,3,7.5 1378,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,3,7.5 1379,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum macrorhynchum,7591226.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum macrorhynchum'],6,3,7.5 1380,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,3,7.5 1381,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum seravschanicum,395973.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum seravschanicum'],6,3,7.5 1382,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudostapfianum,1073593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tuguancunense'],6,3,7.5 1383,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,3,7.5 1384,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XWDPXXKARIDOBG-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(30-5,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H]([C@H](O)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,XWDPXXKARIDOBG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 1385,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,3,7.5 1386,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,3,7.5 1387,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium gueneri,6131660.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gueneri'],6,3,7.5 1388,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 1389,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,3,7.5 1390,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,7.5 1391,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum dolichorhynchum,6131378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum dolichorhynchum'],6,3,7.5 1392,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum legendrei,44349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum legendrei'],6,3,7.5 1393,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,3,7.5 1394,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nagarum,488235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nagarum'],6,3,7.5 1395,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 1396,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,3,7.5 1397,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,3,7.5 1398,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,3,7.5 1399,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,3,7.5 1400,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,3,7.5 1401,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 1402,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,7.5 1403,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,3,7.5 1404,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum columbianum,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,3,7.5 1405,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongoricum,6131511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongoricum'],6,3,7.5 1406,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-QKNOXMJZSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13?,14?,15?,16-,17?,18?,19?,20?,21?,22-,23-,24?/m0/s1",CCN1C[C@]2(COC)CCC(OC)C34C5CC6C(O)C5[C@](O)(C[C@@H]6OC)C(CC32)C14,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,3,7.5 1407,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 1408,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,7.5 1409,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sanyoense,675791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sanyoense'],6,3,7.5 1410,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sczukinii,7049059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sczukinii'],6,3,7.5 1411,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,3,7.5 1412,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,3,7.5 1413,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-OGVVJMRYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum macrorhynchum,7591226.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum macrorhynchum'],6,3,7.5 1414,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-NPNNQAKASA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1C(C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tanguticum,1088652.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tanguticum'],6,3,7.5 1415,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,3,7.5 1416,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudostapfianum,1073593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tuguancunense'],6,3,7.5 1417,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,3,7.5 1418,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 1419,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 1420,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 1421,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,3,7.5 1422,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-FIIQKEKKSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15?,16+,17-,18+,19-,20+,21?,22+,23+,24?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C24H39NO5,pos_1_1proton1methanol,421.282823348,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nemorum,44343.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum nemorum'],6,3,7.5 1423,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BDCURAWBZJMFIK-UHFFFAOYSA-N,"InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,BDCURAWBZJMFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum seravschanicum,395973.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum seravschanicum'],6,3,7.5 1424,6427,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,FEOORLCKDHTOCS-SMCICNQZSA-N,"InChI=1S/C24H39NO5/c1-6-25-11-22(2)8-7-15(29-4)24-13-9-12-14(28-3)10-23(27,16(13)18(12)26)17(21(24)25)19(30-5)20(22)24/h12-21,26-27H,6-11H2,1-5H3/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C24H39NO5,pos_1_1proton1methanol,421.2828233479999,FEOORLCKDHTOCS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium roylei,6131791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium roylei'],6,3,7.5 1425,6424,306,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,HTDLFFNOROCNSG-HDBLZOCCSA-N,"InChI=1S/C31H40N2O5/c1-4-33-15-30(16-38-29(36)20-7-5-6-8-23(20)32-17(2)34)12-11-25(37-3)31-22-13-18-9-10-19(26(22)27(18)35)21(28(31)33)14-24(30)31/h5-10,18-19,21-22,24-28,35H,4,11-16H2,1-3H3,(H,32,34)/t18-,19+,21+,22+,24+,25-,26+,27-,28+,30-,31+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@@H]6C=C[C@H]([C@@H](C[C@H]23)[C@@H]14)[C@H]5[C@H]6O,C31H40N2O5,pos_2_1proton1potassium,520.29372238,HTDLFFNOROCNSG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum talassicum,5737809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum talassicum'],6,0,6.0 1426,6423,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_sodium,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 1427,6423,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_sodium,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 1428,6423,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VZEXGWGJXZJLPY-JVTDHSCXSA-N,"InChI=1S/C41H44O23/c42-12-24-29(51)32(54)34(56)39(60-24)58-18-10-21(47)27-23(11-18)59-35(16-4-7-19(45)20(46)9-16)36(31(27)53)63-41-38(33(55)30(52)25(13-43)61-41)64-40-37(28(50)22(48)14-57-40)62-26(49)8-3-15-1-5-17(44)6-2-15/h1-11,22,24-25,28-30,32-34,37-48,50-52,54-56H,12-14H2/b8-3+/t22-,24+,25+,28-,29-,30-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@H]1O,C41H44O23,pos_1_sodium,904.227337668,VZEXGWGJXZJLPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 1429,6420,-1,,,,0.38986945,ISDB,FPBTZQXLGBERTH-PZEZNAACSA-N,"InChI=1S/C13H19NO4/c1-8-11(16)13(18-12(8)17)6-2-3-7-14-9(13)4-5-10(14)15/h8-9,11,16H,2-7H2,1H3/t8-,9-,11-,13-/m0/s1",C[C@@H]1C(=O)O[C@]2(CCCCN3C(=O)CC[C@H]32)[C@H]1O,C13H19NO4,,253.131408088,FPBTZQXLGBERTH,Alkaloids,Ornithine alkaloids,Stemona alkaloids,Stemona tuberosa,523884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Pandanales'],['Stemonaceae'],['Unknown'],['Stemona'],['Stemona tuberosa'],4,0,5.559477806091309 1430,6420,-1,,,,0.38986945,ISDB,FPBTZQXLGBERTH-UHFFFAOYSA-N,"InChI=1S/C13H19NO4/c1-8-11(16)13(18-12(8)17)6-2-3-7-14-9(13)4-5-10(14)15/h8-9,11,16H,2-7H2,1H3",CC1C(=O)OC2(CCCCN3C(=O)CCC32)C1O,C13H19NO4,,253.131408088,FPBTZQXLGBERTH,Alkaloids,Ornithine alkaloids,Stemona alkaloids,Stemona,321001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Pandanales'],['Stemonaceae'],['Unknown'],['Stemona'],['Unknown'],4,0,5.559477806091309 1431,6413,-1,,,,0.32572824,ISDB,,,,,,,MGYHFEOTTMNGCE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.302912950515747 1432,6411,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 1433,6411,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,0,8.0 1434,6411,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 1435,6411,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 1436,6411,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 1437,6411,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,0,8.0 1438,6408,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,ZFAHFNHITMYOLF-KBHLDNDPSA-N,"InChI=1S/C42H46O23/c1-15-28(49)38(64-41-35(56)33(54)30(51)25(63-41)14-58-26(48)9-3-16-2-8-20(45)21(46)10-16)36(57)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-4-6-18(44)7-5-17)39(31(27)52)65-40-34(55)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,38,40-47,49-51,53-57H,13-14H2,1H3/b9-3+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,38+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H46O23,pos_1_sodium,918.242987732,ZFAHFNHITMYOLF,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 1439,6408,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,AOXSSLNAZRFCMH-HXMTWWTKSA-N,"InChI=1S/C42H46O23/c1-15-28(49)34(55)39(65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-3-16-2-8-20(45)21(46)10-16)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-4-6-18(44)7-5-17)38(31(27)52)64-40-35(56)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-3+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O23,pos_1_sodium,918.242987732,AOXSSLNAZRFCMH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,7.5 1440,6408,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,AOXSSLNAZRFCMH-HXMTWWTKSA-N,"InChI=1S/C42H46O23/c1-15-28(49)34(55)39(65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-3-16-2-8-20(45)21(46)10-16)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-4-6-18(44)7-5-17)38(31(27)52)64-40-35(56)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-3+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O23,pos_1_sodium,918.242987732,AOXSSLNAZRFCMH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum chiisanense,921879.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chiisanense'],6,3,7.5 1441,6408,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JHYIWORKFFMOIP-WBHBZCBISA-N,"InChI=1S/C42H46O23/c1-15-28(49)32(53)35(56)40(59-15)60-19-11-22(47)27-23(12-19)61-37(17-5-8-20(45)21(46)10-17)38(31(27)52)64-42-39(34(55)29(50)24(13-43)62-42)65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-4-16-2-6-18(44)7-3-16/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24+,25+,28-,29+,30+,32+,33-,34-,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)cc5)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C42H46O23,pos_1_sodium,918.242987732,JHYIWORKFFMOIP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 1442,6408,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GIZUXLUTUNKVHX-DYHBMNMNSA-N,"InChI=1S/C42H46O23/c1-15-28(49)38(64-41-35(56)33(54)30(51)25(63-41)14-58-26(48)9-4-16-2-6-18(44)7-3-16)36(57)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-5-8-20(45)21(46)10-17)39(31(27)52)65-40-34(55)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,38,40-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,38+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)cc3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H46O23,pos_1_sodium,918.242987732,GIZUXLUTUNKVHX,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,3,7.5 1443,6408,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,CWTBIQKDTPTFSD-PRHOUTJLSA-N,"InChI=1S/C42H46O23/c1-15-28(49)32(53)35(56)40(59-15)60-19-11-22(47)27-23(12-19)61-37(17-4-6-18(44)7-5-17)38(31(27)52)64-42-39(34(55)29(50)24(13-43)62-42)65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-3-16-2-8-20(45)21(46)10-16/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-3+/t15-,24+,25+,28-,29+,30+,32+,33-,34-,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C42H46O23,pos_1_sodium,918.242987732,CWTBIQKDTPTFSD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 1444,6408,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YYBUGTDXSVDSBB-PKKJBDBWSA-N,"InChI=1S/C42H46O23/c1-15-28(49)32(53)35(56)40(59-15)60-19-11-22(47)27-23(12-19)61-37(17-5-8-20(45)21(46)10-17)38(31(27)52)64-42-39(65-41-36(57)33(54)29(50)24(13-43)62-41)34(55)30(51)25(63-42)14-58-26(48)9-4-16-2-6-18(44)7-3-16/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24+,25-,28+,29-,30-,32-,33+,34+,35+,36+,39-,40+,41+,42+/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)cc5)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@H](O)[C@H]1O,C42H46O23,pos_1_sodium,918.242987732,YYBUGTDXSVDSBB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 1445,6405,957,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,MJGSNPALXVHNAT-RJEOBRGXSA-N,"InChI=1S/C26H36O4/c1-18-13-14-22(29-19(2)27)25(5)23(16-21-17-26(18,25)30-24(21,3)4)28-15-9-12-20-10-7-6-8-11-20/h6-12,18,21-23H,13-17H2,1-5H3/b12-9+/t18-,21-,22+,23+,25+,26+/m1/s1",CC(=O)O[C@H]1CC[C@@H](C)[C@@]23C[C@@H](C[C@H](OC/C=C/c4ccccc4)[C@]12C)C(C)(C)O3,C26H36O4,pos_2_2proton,412.261359632,MJGSNPALXVHNAT,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 1446,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,0,6.0 1447,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,0,6.0 1448,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,0,6.0 1449,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,0,6.0 1450,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,0,6.0 1451,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,0,6.0 1452,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,0,6.0 1453,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,0,6.0 1454,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,0,6.0 1455,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,0,6.0 1456,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,0,6.0 1457,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,0,6.0 1458,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,0,6.0 1459,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-MQNNAEJASA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17-,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@H]1O,C21H20O10,pos_1_1proton,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,0,6.0 1460,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_1proton,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 1461,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_1proton,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,0,6.0 1462,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3",CC1OC(Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.1056468399998,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 1463,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-MQNNAEJASA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17-,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@H]1O,C21H20O10,pos_1_1proton,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,0,6.0 1464,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_1proton,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 1465,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_1proton,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,0,6.0 1466,6404,-1,,,,0.0,MS1_match,HQNOUCSPWAGQND-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3",CC1OC(Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.1056468399998,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 1467,6404,-1,,,,0.0,MS1_match,PMWOCSJXZDDAPR-IARDODDQSA-N,"InChI=1S/C21H20O10/c1-8(22)19-17(27)18(28)21(31-19)29-11-6-12(24)14-13(7-11)30-20(16(26)15(14)25)9-2-4-10(23)5-3-9/h2-8,17-19,21-24,26-28H,1H3/t8-,17-,18+,19+,21+/m0/s1",C[C@H](O)[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H]1O,C21H20O10,pos_1_1proton,432.1056468399998,PMWOCSJXZDDAPR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 1468,6404,-1,,,,0.0,MS1_match,PMWOCSJXZDDAPR-IARDODDQSA-N,"InChI=1S/C21H20O10/c1-8(22)19-17(27)18(28)21(31-19)29-11-6-12(24)14-13(7-11)30-20(16(26)15(14)25)9-2-4-10(23)5-3-9/h2-8,17-19,21-24,26-28H,1H3/t8-,17-,18+,19+,21+/m0/s1",C[C@H](O)[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H]1O,C21H20O10,pos_1_1proton,432.1056468399998,PMWOCSJXZDDAPR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 1469,6404,-1,,,,0.0,MS1_match,CAIGUMKGQLGFBR-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-10-12(4-8-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)ccc1O,C21H20O10,pos_1_1proton,432.1056468399999,CAIGUMKGQLGFBR,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 1470,6404,-1,,,,0.0,MS1_match,CAIGUMKGQLGFBR-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-10-12(4-8-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)ccc1O,C21H20O10,pos_1_1proton,432.1056468399999,CAIGUMKGQLGFBR,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 1471,6404,-1,,,,0.0,MS1_match,CAIGUMKGQLGFBR-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-10-12(4-8-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)ccc1O,C21H20O10,pos_1_1proton,432.1056468399999,CAIGUMKGQLGFBR,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1472,6404,-1,,,,0.0,MS1_match,CAIGUMKGQLGFBR-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-10-12(4-8-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)ccc1O,C21H20O10,pos_1_1proton,432.1056468399999,CAIGUMKGQLGFBR,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1473,6404,-1,,,,0.0,MS1_match,WBGMKAAMRFEBHK-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-8-4-12(10-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1O,C21H20O10,pos_1_1proton,432.1056468399999,WBGMKAAMRFEBHK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 1474,6404,-1,,,,0.0,MS1_match,WBGMKAAMRFEBHK-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-8-4-12(10-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1O,C21H20O10,pos_1_1proton,432.1056468399999,WBGMKAAMRFEBHK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 1475,6404,-1,,,,0.0,MS1_match,WBGMKAAMRFEBHK-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-8-4-12(10-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1O,C21H20O10,pos_1_1proton,432.1056468399999,WBGMKAAMRFEBHK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1476,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,0,6.0 1477,6404,-1,,,,0.0,MS1_match,SOSLMHZOJATCCP-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3",CC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C21H20O10,pos_1_1proton,432.10564684,SOSLMHZOJATCCP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,0,6.0 1478,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1479,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 1480,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 1481,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 1482,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,0,6.0 1483,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 1484,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2",O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius macropetalus,230029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius macropetalus'],6,0,6.0 1485,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1486,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-TZYVJGCXSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17+,18-,19+,21-/m0/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,0,6.0 1487,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,0,6.0 1488,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 1489,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 1490,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,0,6.0 1491,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 1492,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2",O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius macropetalus,230029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius macropetalus'],6,0,6.0 1493,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1494,6404,-1,,,,0.0,MS1_match,WBGMKAAMRFEBHK-PZTMCFHLSA-N,"InChI=1S/C21H20O10/c1-30-16-8-4-12(10-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1O,C21H20O10,pos_1_1proton,432.1056468399999,WBGMKAAMRFEBHK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 1495,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-TZYVJGCXSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17+,18-,19+,21-/m0/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,0,6.0 1496,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 1497,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 1498,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,0,6.0 1499,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 1500,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2",O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius macropetalus,230029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius macropetalus'],6,0,6.0 1501,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1502,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-TZYVJGCXSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17+,18-,19+,21-/m0/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,0,6.0 1503,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,0,6.0 1504,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 1505,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1506,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,0,6.0 1507,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 1508,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1509,6404,-1,,,,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_1proton,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,0,6.0 1510,6404,-1,,,,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,0,6.0 1511,6404,-1,,,,0.0,MS1_match,OBPMSXUPNDBUII-GLYWERGQSA-N,"InChI=1S/C21H20O10/c1-8-15(24)20(28)31-21(16(8)25)29-11-6-12(23)14-13(7-11)30-19(18(27)17(14)26)9-2-4-10(22)5-3-9/h2-8,15-16,20-25,27-28H,1H3/t8-,15-,16-,20-,21-/m1/s1",C[C@@H]1[C@@H](O)[C@H](O)O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@@H]1O,C21H20O10,pos_1_1proton,432.10564684,OBPMSXUPNDBUII,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 1512,6401,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_sodium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 1513,6401,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_sodium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 1514,6401,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_sodium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 1515,6401,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,QBXRXORKIXERDE-QLYLRAMCSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40-,41+,42+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_sodium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 1516,6399,-1,,,,0.0,MS1_match,RIXNFYQZWDGQAE-WVFFYYHBSA-N,"InChI=1S/C32H50O4/c1-20(33)36-25-12-13-29(6)23(28(25,4)5)11-14-31(8)24(29)10-9-21-22-19-27(2,3)15-17-32(22,26(34)35)18-16-30(21,31)7/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22?,23-,24?,25?,29?,30?,31?,32?/m0/s1",CC(=O)OC1CCC2(C)C3CC=C4C5CC(C)(C)CCC5(C(=O)O)CCC4(C)C3(C)CC[C@H]2C1(C)C,C32H50O4,pos_1_1proton1ammonium,498.37091008,RIXNFYQZWDGQAE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone raddeana,889147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone raddeana'],7,0,7.0 1517,6399,-1,,,,0.0,MS1_match,RIXNFYQZWDGQAE-WVFFYYHBSA-N,"InChI=1S/C32H50O4/c1-20(33)36-25-12-13-29(6)23(28(25,4)5)11-14-31(8)24(29)10-9-21-22-19-27(2,3)15-17-32(22,26(34)35)18-16-30(21,31)7/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22?,23-,24?,25?,29?,30?,31?,32?/m0/s1",CC(=O)OC1CCC2(C)C3CC=C4C5CC(C)(C)CCC5(C(=O)O)CCC4(C)C3(C)CC[C@H]2C1(C)C,C32H50O4,pos_1_1proton1ammonium,498.37091008,RIXNFYQZWDGQAE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone raddeana,889147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone raddeana'],7,0,7.0 1518,6398,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OLVLMAWQTMXAOD-UHFFFAOYSA-N,"InChI=1S/C15H13NO4/c1-20-15(19)10-6-2-4-8-12(10)16-14(18)11-7-3-5-9-13(11)17/h2-9,17H,1H3,(H,16,18)",COC(=O)c1ccccc1NC(=O)c1ccccc1O,C15H13NO4,pos_2MNa,271.084457896,OLVLMAWQTMXAOD,Alkaloids,Anthranilic acid alkaloids,Anthranillic acid derivatives,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1519,6398,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OLVLMAWQTMXAOD-UHFFFAOYSA-N,"InChI=1S/C15H13NO4/c1-20-15(19)10-6-2-4-8-12(10)16-14(18)11-7-3-5-9-13(11)17/h2-9,17H,1H3,(H,16,18)",COC(=O)c1ccccc1NC(=O)c1ccccc1O,C15H13NO4,pos_2MNa,271.084457896,OLVLMAWQTMXAOD,Alkaloids,Anthranilic acid alkaloids,Anthranillic acid derivatives,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1520,6395,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8334147,ISDB,GSTBDLJYXUQTFK-FXZGYOIDSA-N,"InChI=1S/C32H38O20/c1-9-19(38)28(51-30-24(43)20(39)15(37)7-46-30)26(45)31(48-9)47-8-17-21(40)23(42)25(44)32(50-17)52-29-22(41)18-14(36)5-11(33)6-16(18)49-27(29)10-2-3-12(34)13(35)4-10/h2-6,9,15,17,19-21,23-26,28,30-40,42-45H,7-8H2,1H3/t9-,15+,17+,19-,20-,21-,23-,24+,25+,26+,28+,30-,31+,32-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C32H38O20,,742.195643616,GSTBDLJYXUQTFK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Astragalus galegiformis,530209.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Astragalus'],['Astragalus malacophyllus'],4,3,8.833658695220947 1521,6395,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8334147,ISDB,GSTBDLJYXUQTFK-FODKTCEYSA-N,"InChI=1S/C32H38O20/c1-9-19(38)28(51-30-24(43)20(39)15(37)7-46-30)26(45)31(48-9)47-8-17-21(40)23(42)25(44)32(50-17)52-29-22(41)18-14(36)5-11(33)6-16(18)49-27(29)10-2-3-12(34)13(35)4-10/h2-6,9,15,17,19-21,23-26,28,30-40,42-45H,7-8H2,1H3/t9-,15+,17+,19-,20-,21+,23-,24+,25+,26+,28+,30-,31+,32-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C32H38O20,,742.1956436160001,GSTBDLJYXUQTFK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Camellia japonica,1058514.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia japonica'],4,3,8.833658695220947 1522,6393,-1,,,,0.0,MS1_match,FOIIZKLTJIQQGX-UHFFFAOYSA-N,"InChI=1S/C27H31NO6/c1-11-8-26-9-13-19-25(2)10-14(34-23(32)12-6-4-3-5-7-12)22(31)27(19)20(26)18(30)15(11)17(29)16(26)21(27)28(13)24(25)33/h3-7,13-22,24,29-31,33H,1,8-10H2,2H3",C=C1CC23CC4C5C6(C)CC(OC(=O)c7ccccc7)C(O)C57C(C2C(O)C1C(O)C37)N4C6O,C27H31NO6,pos_1_1proton2acetonitrile,465.215137712,FOIIZKLTJIQQGX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 1523,6392,-1,,,,0.0,MS1_match,LJIDRFNRDLYHNC-VIFPVBQESA-N,"InChI=1S/C12H13NO3/c14-10-5-7-3-4-13-9(1-2-12(13)16)8(7)6-11(10)15/h5-6,9,14-15H,1-4H2/t9-/m0/s1",O=C1CC[C@H]2c3cc(O)c(O)cc3CCN12,C12H13NO3,pos_1_1proton1ammonium,219.089543276,LJIDRFNRDLYHNC,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 1524,6392,-1,,,,0.0,MS1_match,HCHLTWGUUUDWFP-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-5-4-8-6-10(15-2)11(16-3)7-9(8)12(13)14/h4-7H,1-3H3",COc1cc2ccn(C)c(=O)c2cc1OC,C12H13NO3,pos_1_1proton1ammonium,219.089543276,HCHLTWGUUUDWFP,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Thalictrum przewalskii,782787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum przewalskii'],6,0,6.0 1525,6392,-1,,,,0.0,MS1_match,HCHLTWGUUUDWFP-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-5-4-8-6-10(15-2)11(16-3)7-9(8)12(13)14/h4-7H,1-3H3",COc1cc2ccn(C)c(=O)c2cc1OC,C12H13NO3,pos_1_1proton1ammonium,219.089543276,HCHLTWGUUUDWFP,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Thalictrum isopyroides,98291.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum isopyroides'],6,0,6.0 1526,6390,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.4329822,ISDB,RQLWDYSEFWBFBP-FAKSOFLMSA-N,"InChI=1S/C26H28O15/c27-6-16-20(35)21(36)25(41-26-22(37)19(34)14(33)7-38-26)24(40-16)18-12(31)4-11(30)17-13(32)5-15(39-23(17)18)8-1-2-9(28)10(29)3-8/h1-5,14,16,19-22,24-31,33-37H,6-7H2/t14-,16-,19-,20-,21+,22-,24+,25-,26-/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)c(O)cc(O)c12,C26H28O15,,580.1428201959998,RQLWDYSEFWBFBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,3,9.231928825378418 1527,6390,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.4329822,ISDB,RQLWDYSEFWBFBP-VXSQXEALSA-N,"InChI=1S/C26H28O15/c27-6-16-20(35)21(36)25(41-26-22(37)19(34)14(33)7-38-26)24(40-16)18-12(31)4-11(30)17-13(32)5-15(39-23(17)18)8-1-2-9(28)10(29)3-8/h1-5,14,16,19-22,24-31,33-37H,6-7H2/t14-,16+,19-,20+,21-,22+,24-,25+,26-/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O[C@H]3OC[C@@H](O)[C@@H](O)[C@@H]3O)c(O)cc(O)c12,C26H28O15,,580.142820196,RQLWDYSEFWBFBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,3,9.231928825378418 1528,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,TZPMVVDDEWYHIB-VWXBVBANSA-N,"InChI=1S/C42H46O24/c1-14-28(50)32(54)35(57)40(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-42-39(34(56)29(51)24(12-43)63-42)66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32+,33-,34-,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,TZPMVVDDEWYHIB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,2,7.0 1529,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,TZPMVVDDEWYHIB-QBZXYKHESA-N,"InChI=1S/C42H46O24/c1-14-28(50)32(54)35(57)40(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-42-39(34(56)29(51)24(12-43)63-42)66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32+,33-,34-,35+,36+,39+,40+,41-,42-/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O[C@H]4O[C@@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,TZPMVVDDEWYHIB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,2,7.0 1530,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,BAYNPTIBKPKGFB-WARGXTRISA-N,"InChI=1S/C42H46O24/c1-14-28(50)38(65-41-35(57)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)36(58)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)39(31(27)53)66-40-34(56)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,38,40-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24-,25-,28-,29-,30-,32+,33+,34-,35-,36-,38+,40+,41+,42+/m0/s1",C[C@@H]1O[C@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@H](O[C@H]2O[C@@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,BAYNPTIBKPKGFB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,2,7.0 1531,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,BAYNPTIBKPKGFB-XYCWGEMUSA-N,"InChI=1S/C42H46O24/c1-14-28(50)38(65-41-35(57)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)36(58)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)39(31(27)53)66-40-34(56)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,38,40-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,38+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,BAYNPTIBKPKGFB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,2,7.0 1532,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MWAUOMXEJMQMFW-UNMXIFFRSA-N,"InChI=1S/C42H46O24/c1-14-28(50)34(56)39(66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-40-35(57)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,MWAUOMXEJMQMFW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,2,7.0 1533,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MWAUOMXEJMQMFW-UNMXIFFRSA-N,"InChI=1S/C42H46O24/c1-14-28(50)34(56)39(66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-40-35(57)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,MWAUOMXEJMQMFW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum chiisanense,921879.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chiisanense'],6,2,7.0 1534,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,BNYDLXBTNLOWPZ-YYCMBSPASA-N,"InChI=1S/C42H46O24/c1-14-28(50)32(54)35(57)40(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-42-39(66-41-36(58)33(55)29(51)24(12-43)63-41)34(56)30(52)25(64-42)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24-,25+,28-,29+,30+,32+,33-,34-,35-,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@H](O)[C@H]1O,C42H46O24,pos_1_1proton1ammonium,934.2379023520002,BNYDLXBTNLOWPZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,2,7.0 1535,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,DBYRCYCHEZRNKW-CVSCXZIBSA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24+,25-,28+,29+,30+,32+,33-,34-,35-,38+,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,2,7.0 1536,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,DBYRCYCHEZRNKW-CVSCXZIBSA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24+,25-,28+,29+,30+,32+,33-,34-,35-,38+,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,2,7.0 1537,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,DBYRCYCHEZRNKW-CVSCXZIBSA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24+,25-,28+,29+,30+,32+,33-,34-,35-,38+,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,2,7.0 1538,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,DBYRCYCHEZRNKW-MDGSKLIASA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40-,41+,42+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus lanuginosus,714306.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus lanuginosus'],6,2,7.0 1539,6386,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,JAZBWZUFPUBNJK-HVHNSLKISA-N,"InChI=1S/C42H46O24/c1-58-23-8-15(2-5-19(23)46)3-7-27(50)64-38-29(51)22(49)14-59-41(38)66-39-34(56)31(53)26(13-44)63-42(39)65-37-32(54)28-21(48)10-17(60-40-35(57)33(55)30(52)25(12-43)62-40)11-24(28)61-36(37)16-4-6-18(45)20(47)9-16/h2-11,22,25-26,29-31,33-35,38-49,51-53,55-57H,12-14H2,1H3/b7-3+/t22-,25+,26-,29-,30-,31-,33+,34+,35+,38-,39-,40-,41-,42+/m1/s1",COc1cc(/C=C/C(=O)O[C@H]2[C@@H](O[C@H]3[C@H](Oc4c(-c5ccc(O)c(O)c5)oc5cc(O[C@@H]6O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]6O)cc(O)c5c4=O)O[C@H](CO)[C@@H](O)[C@@H]3O)OC[C@@H](O)[C@H]2O)ccc1O,C42H46O24,pos_1_1proton1ammonium,934.237902352,JAZBWZUFPUBNJK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus,387812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Unknown'],6,2,7.0 1540,6385,-1,,,,0.0,MS1_match,WMNBLIKIHCIFJI-OXUVVOBNSA-N,"InChI=1S/C23H28O12/c1-31-15-8-12(9-16(32-2)18(15)26)22(30)33-10-17-19(27)20(28)21(29)23(35-17)34-14-7-11(5-6-24)3-4-13(14)25/h3-4,7-9,17,19-21,23-29H,5-6,10H2,1-2H3/t17-,19-,20+,21-,23-/m1/s1",COc1cc(C(=O)OC[C@H]2O[C@@H](Oc3cc(CCO)ccc3O)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O,C23H28O12,pos_1_1proton2acetonitrile,496.158076336,WMNBLIKIHCIFJI,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 1541,6382,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RKWHWFONKJEUEF-UHFFFAOYSA-O,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1",OCC1OC(Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)C(O)C(O)C1O,C21H21O11+,pos_1_1proton,449.10783791209,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,2,8.0 1542,6381,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,NKFZLEYLWAFYEH-NSSLBSGISA-N,"InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15+,17-,18-,20-,21+,24+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,pos_1_1proton,596.1377348159999,NKFZLEYLWAFYEH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,7.5 1543,6381,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,NKFZLEYLWAFYEH-NSSLBSGISA-N,"InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15+,17-,18-,20-,21+,24+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,pos_1_1proton,596.1377348159999,NKFZLEYLWAFYEH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,7.5 1544,6377,-1,,,,0.562059,ISDB,PQQITYGQJLPDFC-RKQHYHRCSA-N,"InChI=1S/C14H20O8/c15-6-10-11(18)12(19)13(20)14(22-10)21-4-3-7-1-2-8(16)9(17)5-7/h1-2,5,10-20H,3-4,6H2/t10-,11-,12+,13-,14-/m1/s1",OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C14H20O8,,316.1158176,PQQITYGQJLPDFC,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,8.248235940933228 1545,6373,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 1546,6373,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 1547,6373,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 1548,6372,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.48378187,ISDB,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,9.43512749671936 1549,6372,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.48378187,ISDB,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,9.43512749671936 1550,6372,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.48378187,ISDB,OFQWLDJQLTUOPM-SEZQLBJOSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25-,28-,29+,30+,32-,33-,34+,37+,38+,39+,40+,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,,920.222252288,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,9.43512749671936 1551,6372,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.48378187,ISDB,OFQWLDJQLTUOPM-VTFVVPIRSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24-,25+,28+,29-,30-,32-,33+,34+,37-,38+,39+,40-,41+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@H]5O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)OC[C@@H](O)[C@@H]1O,C41H44O24,,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,9.43512749671936 1552,6372,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.48378187,ISDB,OFQWLDJQLTUOPM-FLQGFQTKSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24+,25+,28-,29+,30-,32-,33-,34+,37+,38+,39+,40-,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,3,9.43512749671936 1553,6372,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.48378187,ISDB,OFQWLDJQLTUOPM-FLQGFQTKSA-N,"InChI=1S/C41H44O24/c42-11-24-29(52)32(55)34(57)39(61-24)59-16-9-21(48)27-23(10-16)60-35(15-3-5-18(45)20(47)8-15)36(31(27)54)64-41-38(33(56)30(53)25(12-43)62-41)65-40-37(28(51)22(49)13-58-40)63-26(50)6-2-14-1-4-17(44)19(46)7-14/h1-10,22,24-25,28-30,32-34,37-49,51-53,55-57H,11-13H2/b6-2+/t22-,24+,25+,28-,29+,30-,32-,33-,34+,37+,38+,39+,40-,41-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C41H44O24,,920.2222522880004,OFQWLDJQLTUOPM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,3,9.43512749671936 1554,6369,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton1ammonium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 1555,6369,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton1ammonium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 1556,6369,-1,,,,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_2_2sodium,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 1557,6369,-1,,,,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_2_2sodium,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 1558,6365,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6462613,ISDB,PESDJELQYIQZBG-RMQQFATJSA-N,"InChI=1S/C21H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-18-20(22)21(23)24-19/h9-10,19-20,22H,2-8,11-18H2,1H3/b10-9+/t19-,20-/m1/s1",CCCCCCCC/C=C/CCCCCCC[C@@H]1C[C@@H](O)C(=O)O1,C21H38O3,,338.282095076,PESDJELQYIQZBG,Polyketides,,,Garcinia mannii,155007.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia mannii'],4,0,6.585045099258423 1559,6361,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.0,MS1_match,KJZKMUCLXDFCHA-BZXHIDDVSA-N,"InChI=1S/C33H58O18/c1-13-29(17(35)8-23(44-13)49-30-14(2)43-22(36)9-18(30)40-5)48-24-10-19(41-6)31(15(3)45-24)50-25-11-20(42-7)32(16(4)46-25)51-33-28(39)27(38)26(37)21(12-34)47-33/h13-39H,8-12H2,1-7H3/t13-,14-,15-,16-,17+,18+,19-,20-,21-,22-,23+,24+,25+,26-,27+,28-,29-,30+,31-,32+,33+/m1/s1",CO[C@H]1C[C@H](O)O[C@H](C)[C@@H]1O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@@H](OC)[C@H](O[C@H]3C[C@@H](OC)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1,C33H58O18,pos_2_2sodium,742.362315016,KJZKMUCLXDFCHA,Carbohydrates,Saccharides,Polysaccharides,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,0,6.0 1560,6360,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.22268179,ISDB,,,,,,,FMSCBQFTEBBTMH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.890727162361145 1561,6359,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.63696665,ISDB,LFZAQSKKPHEVOT-UMHPNHICSA-N,"InChI=1S/C25H24O11/c26-16-6-1-14(2-7-16)4-9-21(29)35-19-12-25(34,24(32)33)13-20(23(19)31)36-22(30)10-5-15-3-8-17(27)18(28)11-15/h1-11,19-20,23,26-28,31,34H,12-13H2,(H,32,33)/b9-4+,10-5+/t19-,20-,23+,25-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1O,C25H24O11,,500.131861588,LFZAQSKKPHEVOT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dracocephalum ruyschiana,132786.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Dracocephalum'],['Dracocephalum ruyschiana'],4,3,8.047866582870483 1562,6359,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.63696665,ISDB,LFZAQSKKPHEVOT-UHFFFAOYSA-N,"InChI=1S/C25H24O11/c26-16-6-1-14(2-7-16)4-9-21(29)35-19-12-25(34,24(32)33)13-20(23(19)31)36-22(30)10-5-15-3-8-17(27)18(28)11-15/h1-11,19-20,23,26-28,31,34H,12-13H2,(H,32,33)",O=C(C=Cc1ccc(O)cc1)OC1CC(O)(C(=O)O)CC(OC(=O)C=Cc2ccc(O)c(O)c2)C1O,C25H24O11,,500.1318615879999,LFZAQSKKPHEVOT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Artemisia annua,637444.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia annua'],4,3,8.047866582870483 1563,6358,429,Polyketides,Phloroglucinols,Acyl phloroglucinols,0.5173213,ISDB,SFMNMSZFHGJDAG-UHFFFAOYSA-N,"InChI=1S/C14H12O6/c1-20-10-5-11(17)13(12(18)6-10)14(19)7-2-8(15)4-9(16)3-7/h2-6,15-18H,1H3",COc1cc(O)c(C(=O)c2cc(O)cc(O)c2)c(O)c1,C14H12O6,,276.063388104,SFMNMSZFHGJDAG,Polyketides,Phloroglucinols,Acyl phloroglucinols,Hypericum annulatum,541328.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum annulatum'],4,3,7.569285154342651 1564,6355,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.22571246,ISDB,,,,,,,AZJMADMFGOSPKW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9028498530387878 1565,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 1566,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 1567,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 1568,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 1569,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1570,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1571,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 1572,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 1573,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 1574,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 1575,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum podocarpum,119512.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum podocarpum'],6,0,6.0 1576,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 1577,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 1578,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 1579,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 1580,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1581,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 1582,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 1583,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 1584,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 1585,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 1586,6354,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum podocarpum,119512.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum podocarpum'],6,0,6.0 1587,6354,-1,,,,0.0,MS1_match,DKXNBNKWCZZMJT-JUUDDBOJSA-N,"InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h1,4-12,14-21H,2-3H2/t4-,5+,6+,7+,8+,9-,10+,11-,12+/m0/s1",O=C[C@H](O)[C@@H](O)[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C12H22O11,pos_1_1proton1ammonium,342.116211524,DKXNBNKWCZZMJT,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 1588,6354,-1,,,,0.0,MS1_match,DKXNBNKWCZZMJT-JUUDDBOJSA-N,"InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h1,4-12,14-21H,2-3H2/t4-,5+,6+,7+,8+,9-,10+,11-,12+/m0/s1",O=C[C@H](O)[C@@H](O)[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C12H22O11,pos_1_1proton1ammonium,342.116211524,DKXNBNKWCZZMJT,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 1589,6349,236,,,,0.24380974,ISDB,,,,,,,VJVDYBXGAPKGPU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9752389788627625 1590,6347,391,Alkaloids,Ornithine alkaloids,Polyamines,0.6047332,ISDB,AKIHYQWCLCDMMI-VMPITWQZSA-N,"InChI=1S/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)/b8-5+",N=C(N)NCCCCNC(=O)/C=C/c1ccc(O)cc1,C14H20N4O2,,276.15862588,AKIHYQWCLCDMMI,Alkaloids,Ornithine alkaloids,Polyamines,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.918932914733887 1591,6347,391,Alkaloids,Ornithine alkaloids,Polyamines,0.6047332,ISDB,AKIHYQWCLCDMMI-UHFFFAOYSA-N,"InChI=1S/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)",N=C(N)NCCCCNC(=O)C=Cc1ccc(O)cc1,C14H20N4O2,,276.15862588,AKIHYQWCLCDMMI,Alkaloids,Ornithine alkaloids,Polyamines,Albizia julibrissin,39517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Albizia'],['Albizia julibrissin'],4,3,7.918932914733887 1592,6335,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.3359099,ISDB,LAVPYPMOBSOJLD-OPMXSGTGSA-N,"InChI=1S/C22H20O11/c1-9(24)30-20-15(8-23)32-22(18(20)29)33-21-17(28)16-13(27)6-12(26)7-14(16)31-19(21)10-2-4-11(25)5-3-10/h2-7,15,18,20,22-23,25-27,29H,8H2,1H3/t15-,18+,20-,22-/m0/s1",CC(=O)O[C@@H]1[C@@H](O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@H]1CO,C22H20O11,,460.10056146,LAVPYPMOBSOJLD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rodgersia podophylla,429366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Saxifragaceae'],['Unknown'],['Rodgersia'],['Rodgersia podophylla'],4,2,6.343639612197876 1593,6334,-1,,,,0.8534914,ISDB,LLMVHKRJAVIEOD-APRNLGALSA-N,"InChI=1S/C29H32O16/c1-10(30)24-20(36)22(38)29(43-24)44-26-17(9-40-11(2)31)42-28(23(39)21(26)37)45-27-19(35)18-15(34)7-14(33)8-16(18)41-25(27)12-3-5-13(32)6-4-12/h3-8,10,17,20-24,26,28-30,32-34,36-39H,9H2,1-2H3/t10-,17+,20-,21+,22+,23+,24-,26+,28-,29-/m0/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O[C@@H]1O[C@@H]([C@H](C)O)[C@@H](O)[C@H]1O,C29H32O16,,636.169034944,LLMVHKRJAVIEOD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rosa multiflora,908464.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa multiflora'],4,0,7.413965702056885 1594,6333,-1,,,,0.61093384,ISDB,BNUCXCGZTSEDGK-YTOAEBAASA-N,"InChI=1S/C29H32O15/c1-10-19(33)21(35)23(37)28(39-10)42-15-8-16(32)18-17(9-15)43-26(13-4-6-14(31)7-5-13)27(20(18)34)44-29-24(38)22(36)25(11(2)40-29)41-12(3)30/h4-11,19,21-25,28-29,31-33,35-38H,1-3H3/t10?,11?,19-,21-,22?,23?,24-,25-,28-,29+/m0/s1",CC(=O)O[C@H]1C(C)O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc(O)c3c2=O)[C@@H](O)C1O,C29H32O15,,620.1741203239999,BNUCXCGZTSEDGK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Epimedium sutchuenense,709042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium sutchuenense'],4,0,6.443735361099243 1595,6333,-1,,,,0.61093384,ISDB,BNUCXCGZTSEDGK-PPGKSNAPSA-N,"InChI=1S/C29H32O15/c1-10-19(33)21(35)23(37)28(39-10)42-15-8-16(32)18-17(9-15)43-26(13-4-6-14(31)7-5-13)27(20(18)34)44-29-24(38)22(36)25(11(2)40-29)41-12(3)30/h4-11,19,21-25,28-29,31-33,35-38H,1-3H3/t10-,11-,19-,21+,22-,23+,24+,25-,28-,29-/m0/s1",CC(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)O[C@H]1C,C29H32O15,,620.1741203239999,BNUCXCGZTSEDGK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lotus tenuis,484504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus tenuis'],4,0,6.443735361099243 1596,6333,-1,,,,0.61093384,ISDB,BNUCXCGZTSEDGK-PPGKSNAPSA-N,"InChI=1S/C29H32O15/c1-10-19(33)21(35)23(37)28(39-10)42-15-8-16(32)18-17(9-15)43-26(13-4-6-14(31)7-5-13)27(20(18)34)44-29-24(38)22(36)25(11(2)40-29)41-12(3)30/h4-11,19,21-25,28-29,31-33,35-38H,1-3H3/t10-,11-,19-,21+,22-,23+,24+,25-,28-,29-/m0/s1",CC(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)O[C@H]1C,C29H32O15,,620.1741203239999,BNUCXCGZTSEDGK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lotus hirsutus,7055639.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus hirsutus'],4,0,6.443735361099243 1597,6333,-1,,,,0.61093384,ISDB,BNUCXCGZTSEDGK-PPGKSNAPSA-N,"InChI=1S/C29H32O15/c1-10-19(33)21(35)23(37)28(39-10)42-15-8-16(32)18-17(9-15)43-26(13-4-6-14(31)7-5-13)27(20(18)34)44-29-24(38)22(36)25(11(2)40-29)41-12(3)30/h4-11,19,21-25,28-29,31-33,35-38H,1-3H3/t10-,11-,19-,21+,22-,23+,24+,25-,28-,29-/m0/s1",CC(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)O[C@H]1C,C29H32O15,,620.1741203239999,BNUCXCGZTSEDGK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Dorycnium hirsutum,253729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Dorycnium'],['Dorycnium hirsutum'],4,0,6.443735361099243 1598,6330,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.20880663,ISDB,DBLLZDYDAFRZEE-SJIRYBADSA-N,"InChI=1S/C8H12O5/c1-4(9)8-6(12-5(2)10)3-7(11)13-8/h4,6,8-9H,3H2,1-2H3/t4-,6+,8-/m0/s1",CC(=O)O[C@@H]1CC(=O)O[C@H]1[C@H](C)O,C8H12O5,,188.068473484,DBLLZDYDAFRZEE,,,,Tapinella atrotomentosa,834577.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Boletales'],['Tapinellaceae'],['Unknown'],['Tapinella'],['Tapinella atrotomentosa'],1,0,1.8352265357971191 1599,6329,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.81688005,ISDB,REFJWTPEDVJJIY-UHFFFAOYSA-N,"InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H",O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O7,,302.04265266,REFJWTPEDVJJIY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,11.767520189285278 1600,6328,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IQPNAANSBPBGFQ-UHFFFAOYSA-N,"InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O6,pos_1_1proton,286.04773804,IQPNAANSBPBGFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,9.0 1601,6327,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.2788772,ISDB,KULGJNLEWICRST-LABWTSPLSA-N,"InChI=1S/C29H42O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-11,18-21,25,27H,7,12-17H2,1-6H3/b9-8+/t20-,21-,25-,27+,28+,29-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CCC2=C3C=CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(C)C,C29H42O,,406.323565964,KULGJNLEWICRST,Terpenoids,Steroids,Stigmastane steroids,Ailanthus altissima,30793.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Simaroubaceae'],['Unknown'],['Ailanthus'],['Ailanthus altissima'],4,1,5.615508794784546 1602,6326,109,Terpenoids,Diterpenoids,Estrane steroids,0.6103174,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.941269636154175 1603,6325,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.64825326,ISDB,WWUZIQQURGPMPG-KRWOKUGFSA-N,"InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1",CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO,C18H37NO2,,299.282429424,WWUZIQQURGPMPG,Fatty acids,Sphingolipids,Sphingoid bases,Rehmannia glutinosa,164453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Unknown'],['Rehmannia'],['Rehmannia glutinosa'],4,2,7.593013048171997 1604,6325,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.64825326,ISDB,WWUZIQQURGPMPG-KRWOKUGFSA-N,"InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1",CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO,C18H37NO2,,299.282429424,WWUZIQQURGPMPG,Fatty acids,Sphingolipids,Sphingoid bases,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,2,7.593013048171997 1605,6325,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.64825326,ISDB,WWUZIQQURGPMPG-KRWOKUGFSA-N,"InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1",CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO,C18H37NO2,,299.282429424,WWUZIQQURGPMPG,Fatty acids,Sphingolipids,Sphingoid bases,Pogostemon cablin,595162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Pogostemoneae'],['Pogostemon'],['Pogostemon cablin'],4,2,7.593013048171997 1606,6325,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.64825326,ISDB,WWUZIQQURGPMPG-KRWOKUGFSA-N,"InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1",CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO,C18H37NO2,,299.282429424,WWUZIQQURGPMPG,Fatty acids,Sphingolipids,Sphingoid bases,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,2,7.593013048171997 1607,6322,688,Terpenoids,Octadecanoids,Other Octadecanoids,0.70938426,ISDB,ACHDMUPTZYZIGR-JPAZTHTMSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3+,8-6+,14-11+",CC/C=C/C/C=C/C=C/C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,8.337537050247192 1608,6322,688,Terpenoids,Octadecanoids,Other Octadecanoids,0.70938426,ISDB,ACHDMUPTZYZIGR-CUHSZNQNSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3-,8-6-,14-11+",CC/C=C\C/C=C\C=C\C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Isatis tinctoria,631500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Isatideae'],['Isatis'],['Isatis tinctoria'],4,3,8.337537050247192 1609,6316,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.20624495,ISDB,,,,,,,FIRYVNFRBPOEGB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8249797821044922 1610,6315,1393,Polyketides,Chromanes,Chromones,0.0,MS1_match,XLZRRNWHQQRALT-PEVLUNPASA-N,"InChI=1S/C21H24O10/c1-9-4-12(23)16-13(24)5-14-11(20(16)30-9)3-2-10(7-28-14)8-29-21-19(27)18(26)17(25)15(6-22)31-21/h2,4-5,15,17-19,21-22,24-27H,3,6-8H2,1H3/t15-,17-,18+,19-,21-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)CC=C(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CO3,C21H24O10,pos_1_1proton,436.136946968,XLZRRNWHQQRALT,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 1611,6313,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.64883184,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,3,10.095327377319336 1612,6313,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.64883184,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,3,10.095327377319336 1613,6313,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.64883184,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,10.095327377319336 1614,6313,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.64883184,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,10.095327377319336 1615,6312,-1,,,,0.0,MS1_match,VJVAGEFZPPWVPV-QACLQDTKSA-N,"InChI=1S/C36H40N2O6/c1-37-13-11-23-18-32(41-3)33-19-26(23)28(37)16-22-7-10-30(39)31(17-22)43-24-8-5-21(6-9-24)15-29-27-20-34(42-4)35(40)36(44-33)25(27)12-14-38(29)2/h5-10,17-20,23,26,28-29,39-40H,11-16H2,1-4H3/t23-,26-,28-,29-/m0/s1",COC1=C[C@@H]2CCN(C)[C@H]3Cc4ccc(O)c(c4)Oc4ccc(cc4)C[C@H]4c5cc(OC)c(O)c(c5CCN4C)OC1=C[C@@H]23,C36H40N2O6,pos_1_minus1proton2potassium,596.288637,VJVAGEFZPPWVPV,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 1616,6311,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.40602916,ISDB,FSMNQWHKVQFXMJ-NRYKUPCLSA-N,"InChI=1S/C36H54O11/c1-31(30(44)45)15-19-18-7-8-21-33(3)11-10-23(46-29-26(41)24(39)25(40)27(47-29)28(42)43)34(4,17-37)20(33)9-12-36(21,6)35(18,5)14-13-32(19,2)22(38)16-31/h7,19-21,23-27,29,37,39-41H,8-17H2,1-6H3,(H,42,43)(H,44,45)/t19-,20+,21+,23-,24-,25-,26+,27-,29+,31-,32+,33-,34+,35+,36+/m0/s1",C[C@@]1(C(=O)O)CC(=O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H54O11,,662.366612548,FSMNQWHKVQFXMJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Trifolium repens,116218.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trifolium'],['Trifolium repens'],4,3,7.124116659164429 1617,6310,-1,,,,0.60307825,ISDB,JAKAZHIACKJNNB-RTBURBONSA-N,"InChI=1S/C19H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h1,18-19,21-22H,4-16H2,2H3/t18-,19-/m1/s1",C#CCCCCCCCCCCC[C@@H](O)C[C@@H](O)COC(C)=O,C19H34O4,,326.24570956799994,JAKAZHIACKJNNB,Fatty acids,Fatty acyls,Fatty alcohols,Persea americana,913249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Persea'],['Persea americana'],4,0,6.412312984466553 1618,6300,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_1potassium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 1619,6300,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_1potassium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 1620,6300,-1,,,,0.0,MS1_match,VRYWDBDPXMHHGE-HRPPYHBASA-N,"InChI=1S/C33H40O20/c1-10-19(38)23(42)26(45)31(47-10)48-13-6-14(37)18-15(7-13)49-28(11-2-4-12(36)5-3-11)29(22(18)41)52-33-30(25(44)21(40)17(9-35)51-33)53-32-27(46)24(43)20(39)16(8-34)50-32/h2-7,10,16-17,19-21,23-27,30-40,42-46H,8-9H2,1H3/t10-,16+,17+,19-,20+,21-,23+,24-,25-,26+,27+,30+,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_1potassium,756.21129368,VRYWDBDPXMHHGE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella damascena,387814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella damascena'],6,0,6.0 1621,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TZPMVVDDEWYHIB-VWXBVBANSA-N,"InChI=1S/C42H46O24/c1-14-28(50)32(54)35(57)40(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-42-39(34(56)29(51)24(12-43)63-42)66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32+,33-,34-,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C42H46O24,pos_1_sodium,934.237902352,TZPMVVDDEWYHIB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 1622,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TZPMVVDDEWYHIB-QBZXYKHESA-N,"InChI=1S/C42H46O24/c1-14-28(50)32(54)35(57)40(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-42-39(34(56)29(51)24(12-43)63-42)66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32+,33-,34-,35+,36+,39+,40+,41-,42-/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O[C@H]4O[C@@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_sodium,934.237902352,TZPMVVDDEWYHIB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 1623,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BAYNPTIBKPKGFB-WARGXTRISA-N,"InChI=1S/C42H46O24/c1-14-28(50)38(65-41-35(57)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)36(58)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)39(31(27)53)66-40-34(56)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,38,40-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24-,25-,28-,29-,30-,32+,33+,34-,35-,36-,38+,40+,41+,42+/m0/s1",C[C@@H]1O[C@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@H](O[C@H]2O[C@@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H]1O,C42H46O24,pos_1_sodium,934.237902352,BAYNPTIBKPKGFB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 1624,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BAYNPTIBKPKGFB-XYCWGEMUSA-N,"InChI=1S/C42H46O24/c1-14-28(50)38(65-41-35(57)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)36(58)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)39(31(27)53)66-40-34(56)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,38,40-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,38+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H46O24,pos_1_sodium,934.237902352,BAYNPTIBKPKGFB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,3,7.5 1625,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MWAUOMXEJMQMFW-UNMXIFFRSA-N,"InChI=1S/C42H46O24/c1-14-28(50)34(56)39(66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-40-35(57)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O24,pos_1_sodium,934.237902352,MWAUOMXEJMQMFW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,7.5 1626,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MWAUOMXEJMQMFW-UNMXIFFRSA-N,"InChI=1S/C42H46O24/c1-14-28(50)34(56)39(66-41-36(58)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-40-35(57)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O24,pos_1_sodium,934.237902352,MWAUOMXEJMQMFW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum chiisanense,921879.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chiisanense'],6,3,7.5 1627,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BNYDLXBTNLOWPZ-YYCMBSPASA-N,"InChI=1S/C42H46O24/c1-14-28(50)32(54)35(57)40(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-42-39(66-41-36(58)33(55)29(51)24(12-43)63-41)34(56)30(52)25(64-42)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24-,25+,28-,29+,30+,32+,33-,34-,35-,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@H](O)[C@H]1O,C42H46O24,pos_1_sodium,934.2379023520002,BNYDLXBTNLOWPZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 1628,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DBYRCYCHEZRNKW-CVSCXZIBSA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24+,25-,28+,29+,30+,32+,33-,34-,35-,38+,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_sodium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 1629,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DBYRCYCHEZRNKW-CVSCXZIBSA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24+,25-,28+,29+,30+,32+,33-,34-,35-,38+,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_sodium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 1630,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DBYRCYCHEZRNKW-CVSCXZIBSA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24+,25-,28+,29+,30+,32+,33-,34-,35-,38+,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]5O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_sodium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 1631,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DBYRCYCHEZRNKW-MDGSKLIASA-N,"InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40-,41+,42+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O24,pos_1_sodium,934.237902352,DBYRCYCHEZRNKW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus lanuginosus,714306.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus lanuginosus'],6,3,7.5 1632,6299,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JAZBWZUFPUBNJK-HVHNSLKISA-N,"InChI=1S/C42H46O24/c1-58-23-8-15(2-5-19(23)46)3-7-27(50)64-38-29(51)22(49)14-59-41(38)66-39-34(56)31(53)26(13-44)63-42(39)65-37-32(54)28-21(48)10-17(60-40-35(57)33(55)30(52)25(12-43)62-40)11-24(28)61-36(37)16-4-6-18(45)20(47)9-16/h2-11,22,25-26,29-31,33-35,38-49,51-53,55-57H,12-14H2,1H3/b7-3+/t22-,25+,26-,29-,30-,31-,33+,34+,35+,38-,39-,40-,41-,42+/m1/s1",COc1cc(/C=C/C(=O)O[C@H]2[C@@H](O[C@H]3[C@H](Oc4c(-c5ccc(O)c(O)c5)oc5cc(O[C@@H]6O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]6O)cc(O)c5c4=O)O[C@H](CO)[C@@H](O)[C@@H]3O)OC[C@@H](O)[C@H]2O)ccc1O,C42H46O24,pos_1_sodium,934.237902352,JAZBWZUFPUBNJK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus,387812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Unknown'],6,3,7.5 1633,6292,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.6558957,ISDB,BRYZTZMVXZZLPD-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C1OC(CO)C(O)C(O)C1O,C22H22O11,,462.116211524,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,3,10.12358283996582 1634,6292,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.6558957,ISDB,BRYZTZMVXZZLPD-PGPONNFDSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,,462.1162115239999,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,3,10.12358283996582 1635,6291,1048,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.5536521,ISDB,ZFAHFNHITMYOLF-KBHLDNDPSA-N,"InChI=1S/C42H46O23/c1-15-28(49)38(64-41-35(56)33(54)30(51)25(63-41)14-58-26(48)9-3-16-2-8-20(45)21(46)10-16)36(57)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-4-6-18(44)7-5-17)39(31(27)52)65-40-34(55)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,38,40-47,49-51,53-57H,13-14H2,1H3/b9-3+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,38+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H46O23,,918.242987732,ZFAHFNHITMYOLF,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,9.714608430862427 1636,6289,-1,,,,0.0,MS1_match,LHSMCOYXDSMPQS-ULBWLWKQSA-N,"InChI=1S/C21H27NO4/c1-9-5-20-6-11(23)16-19(2)8-22(3)17-14(20)15(25)10(9)4-13(20)21(16,17)7-12(24)18(19)26/h10,12-14,16-18,24,26H,1,4-8H2,2-3H3/t10-,12+,13+,14+,16+,17+,18+,19-,20+,21+/m0/s1",C=C1C[C@]23CC(=O)[C@@H]4[C@]5(C)CN(C)[C@@H]6[C@H]2C(=O)[C@H]1C[C@H]3[C@]46C[C@@H](O)[C@H]5O,C21H27NO4,pos_1_minus1proton2potassium,357.194008344,LHSMCOYXDSMPQS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium albiflorum,6131751.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium albiflorum'],6,0,6.0 1637,6289,-1,,,,0.0,MS1_match,LHSMCOYXDSMPQS-UHFFFAOYSA-N,"InChI=1S/C21H27NO4/c1-9-5-20-6-11(23)16-19(2)8-22(3)17-14(20)15(25)10(9)4-13(20)21(16,17)7-12(24)18(19)26/h10,12-14,16-18,24,26H,1,4-8H2,2-3H3",C=C1CC23CC(=O)C4C5(C)CN(C)C6C2C(=O)C1CC3C64CC(O)C5O,C21H27NO4,pos_1_minus1proton2potassium,357.194008344,LHSMCOYXDSMPQS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum heterophyllum,124446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum heterophyllum'],6,0,6.0 1638,6288,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.58875304,ISDB,MPYHGNAJOKCMAQ-UHFFFAOYSA-N,"InChI=1S/C20H25NO4/c1-21-8-7-14-11-19(24-3)20(25-4)12-15(14)16(21)9-13-5-6-18(23-2)17(22)10-13/h5-6,10-12,16,22H,7-9H2,1-4H3",COc1ccc(CC2c3cc(OC)c(OC)cc3CCN2C)cc1O,C20H25NO4,,343.17835828,MPYHGNAJOKCMAQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Stephania macrantha,5503511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Cissampelideae'],['Stephania'],['Stephania macrantha'],5,3,8.85501217842102 1639,6288,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.58875304,ISDB,MPYHGNAJOKCMAQ-UHFFFAOYSA-N,"InChI=1S/C20H25NO4/c1-21-8-7-14-11-19(24-3)20(25-4)12-15(14)16(21)9-13-5-6-18(23-2)17(22)10-13/h5-6,10-12,16,22H,7-9H2,1-4H3",COc1ccc(CC2c3cc(OC)c(OC)cc3CCN2C)cc1O,C20H25NO4,,343.17835828,MPYHGNAJOKCMAQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver somniferum,438118.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver somniferum'],5,3,8.85501217842102 1640,6288,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.58875304,ISDB,MPYHGNAJOKCMAQ-UHFFFAOYSA-N,"InChI=1S/C20H25NO4/c1-21-8-7-14-11-19(24-3)20(25-4)12-15(14)16(21)9-13-5-6-18(23-2)17(22)10-13/h5-6,10-12,16,22H,7-9H2,1-4H3",COc1ccc(CC2c3cc(OC)c(OC)cc3CCN2C)cc1O,C20H25NO4,,343.17835828,MPYHGNAJOKCMAQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Stephania aculeata,5727732.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Anomospermeae'],['Echinostephia'],['Echinostephia aculeata'],5,3,8.85501217842102 1641,6288,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.58875304,ISDB,MPYHGNAJOKCMAQ-UHFFFAOYSA-N,"InChI=1S/C20H25NO4/c1-21-8-7-14-11-19(24-3)20(25-4)12-15(14)16(21)9-13-5-6-18(23-2)17(22)10-13/h5-6,10-12,16,22H,7-9H2,1-4H3",COc1ccc(CC2c3cc(OC)c(OC)cc3CCN2C)cc1O,C20H25NO4,,343.17835828,MPYHGNAJOKCMAQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Stephania bancroftii,6130042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Cissampelideae'],['Stephania'],['Stephania bancroftii'],5,3,8.85501217842102 1642,6288,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.58875304,ISDB,MPYHGNAJOKCMAQ-INIZCTEOSA-N,"InChI=1S/C20H25NO4/c1-21-8-7-14-11-19(24-3)20(25-4)12-15(14)16(21)9-13-5-6-18(23-2)17(22)10-13/h5-6,10-12,16,22H,7-9H2,1-4H3/t16-/m0/s1",COc1ccc(C[C@H]2c3cc(OC)c(OC)cc3CCN2C)cc1O,C20H25NO4,,343.17835828,MPYHGNAJOKCMAQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Stephania cephalantha,292978.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Cissampelideae'],['Stephania'],['Stephania cephalantha'],5,3,8.85501217842102 1643,6288,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.58875304,ISDB,MPYHGNAJOKCMAQ-INIZCTEOSA-N,"InChI=1S/C20H25NO4/c1-21-8-7-14-11-19(24-3)20(25-4)12-15(14)16(21)9-13-5-6-18(23-2)17(22)10-13/h5-6,10-12,16,22H,7-9H2,1-4H3/t16-/m0/s1",COc1ccc(C[C@H]2c3cc(OC)c(OC)cc3CCN2C)cc1O,C20H25NO4,,343.17835828,MPYHGNAJOKCMAQ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Stephania viridiflavens,5503510.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Cissampelideae'],['Stephania'],['Stephania viridiflavens'],5,3,8.85501217842102 1644,6287,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_2_1proton1sodium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 1645,6287,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_2_1proton1sodium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 1646,6287,-1,,,,0.0,MS1_match,VRYWDBDPXMHHGE-HRPPYHBASA-N,"InChI=1S/C33H40O20/c1-10-19(38)23(42)26(45)31(47-10)48-13-6-14(37)18-15(7-13)49-28(11-2-4-12(36)5-3-11)29(22(18)41)52-33-30(25(44)21(40)17(9-35)51-33)53-32-27(46)24(43)20(39)16(8-34)50-32/h2-7,10,16-17,19-21,23-27,30-40,42-46H,8-9H2,1H3/t10-,16+,17+,19-,20+,21-,23+,24-,25-,26+,27+,30+,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_2_1proton1sodium,756.21129368,VRYWDBDPXMHHGE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella damascena,387814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella damascena'],6,0,6.0 1647,6285,-1,,,,0.0,MS1_match,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_1proton1ammonium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,0,6.0 1648,6285,-1,,,,0.0,MS1_match,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_1proton1ammonium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,0,6.0 1649,6285,-1,,,,0.0,MS1_match,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_1proton1ammonium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,0,6.0 1650,6285,-1,,,,0.0,MS1_match,QBXRXORKIXERDE-QLYLRAMCSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40-,41+,42+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,pos_1_1proton1ammonium,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,6.0 1651,6283,-1,,,,0.0,MS1_match,GFWVOYYNAJHXJE-DRKGPFKDSA-N,"InChI=1S/C24H28O15/c25-5-13-17(28)19(30)21(32)24(38-13)36-7-14-18(29)20(31)22(33)23(39-14)35-6-8-3-10(26)15-12(37-8)4-11-9(16(15)27)1-2-34-11/h1-4,13-14,17-25,27-33H,5-7H2/t13-,14-,17-,18-,19+,20+,21-,22-,23-,24-/m1/s1",O=c1cc(CO[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)oc2cc3occc3c(O)c12,C24H28O15,pos_1_sodium,556.142820196,GFWVOYYNAJHXJE,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 1652,6283,-1,,,,0.0,MS1_match,GFWVOYYNAJHXJE-DRKGPFKDSA-N,"InChI=1S/C24H28O15/c25-5-13-17(28)19(30)21(32)24(38-13)36-7-14-18(29)20(31)22(33)23(39-14)35-6-8-3-10(26)15-12(37-8)4-11-9(16(15)27)1-2-34-11/h1-4,13-14,17-25,27-33H,5-7H2/t13-,14-,17-,18-,19+,20+,21-,22-,23-,24-/m1/s1",O=c1cc(CO[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)oc2cc3occc3c(O)c12,C24H28O15,pos_1_sodium,556.142820196,GFWVOYYNAJHXJE,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 1653,6281,-1,,,,0.0,MS1_match,CTNPHHZPAJYPFO-QFLJTSPFSA-N,"InChI=1S/C42H64O19/c1-19-35(60-38-34(51)32(49)36(27(16-44)59-38)61-37-33(50)31(48)30(47)26(15-43)58-37)25(54-3)13-29(56-19)57-21-4-9-40(18-45)23-5-8-39(2)22(20-12-28(46)55-17-20)7-11-42(39,53)24(23)6-10-41(40,52)14-21/h12,18-19,21-27,29-38,43-44,47-53H,4-11,13-17H2,1-3H3/t19-,21+,22-,23+,24-,25+,26-,27-,29+,30-,31+,32-,33-,34-,35-,36-,37+,38+,39-,40+,41+,42+/m1/s1",CO[C@H]1C[C@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)O[C@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H64O19,pos_2_1proton1potassium,872.404179828,CTNPHHZPAJYPFO,Terpenoids,Steroids,Cardenolides,Adonis mongolica,6130927.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis mongolica'],6,0,6.0 1654,6281,-1,,,,0.0,MS1_match,GILGYKHFZXQALF-FBPIOBPTSA-N,"InChI=1S/C42H64O19/c1-19-36(61-38-35(51)33(49)31(47)27(60-38)17-56-37-34(50)32(48)30(46)26(15-43)59-37)25(54-3)13-29(57-19)58-21-4-9-40(18-44)23-5-8-39(2)22(20-12-28(45)55-16-20)7-11-42(39,53)24(23)6-10-41(40,52)14-21/h12,18-19,21-27,29-38,43,46-53H,4-11,13-17H2,1-3H3/t19-,21+,22-,23+,24-,25+,26-,27-,29+,30-,31-,32+,33+,34-,35-,36-,37-,38+,39-,40+,41+,42+/m1/s1",CO[C@H]1C[C@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)O[C@H](C)[C@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C42H64O19,pos_2_1proton1potassium,872.4041798280001,GILGYKHFZXQALF,Terpenoids,Steroids,Cardenolides,Adonis mongolica,6130927.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis mongolica'],6,0,6.0 1655,6280,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8768141,ISDB,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,3,13.007256507873535 1656,6280,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8768141,ISDB,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,13.007256507873535 1657,6280,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8768141,ISDB,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,3,13.007256507873535 1658,6279,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.5504286,ISDB,CMHKKALEZOJWDP-JXKRDHHRSA-N,"InChI=1S/C51H52O28/c52-16-33-39(62)42(65)45(68)51(77-33)76-32-15-23-29(13-22(53)14-30(23)74-49-46(69)43(66)40(63)34(78-49)17-71-36(59)7-3-19-1-5-24(54)26(56)9-19)73-48(32)21-11-28(58)38(61)31(12-21)75-50-47(70)44(67)41(64)35(79-50)18-72-37(60)8-4-20-2-6-25(55)27(57)10-20/h1-15,33-35,39-47,49-52,62-70H,16-18H2,(H6-,53,54,55,56,57,58,59,60,61)/t33-,34-,35-,39-,40-,41-,42+,43+,44+,45-,46-,47-,49-,50-,51-/m1/s1",O=C(C=Cc1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc(-c3[o+]c4cc(O)cc(O[C@@H]5O[C@H](COC(=O)C=Cc6ccc(O)c(O)c6)[C@@H](O)[C@H](O)[C@H]5O)c4cc3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c2[O-])[C@H](O)[C@@H](O)[C@@H]1O,C51H52O28,,1112.264511024,CMHKKALEZOJWDP,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Gentiana,168233.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Gentiana'],['Unknown'],4,2,7.201714515686035 1659,6279,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.5504286,ISDB,CMHKKALEZOJWDP-JXKRDHHRSA-O,"InChI=1S/C51H52O28/c52-16-33-39(62)42(65)45(68)51(77-33)76-32-15-23-29(13-22(53)14-30(23)74-49-46(69)43(66)40(63)34(78-49)17-71-36(59)7-3-19-1-5-24(54)26(56)9-19)73-48(32)21-11-28(58)38(61)31(12-21)75-50-47(70)44(67)41(64)35(79-50)18-72-37(60)8-4-20-2-6-25(55)27(57)10-20/h1-15,33-35,39-47,49-52,62-70H,16-18H2,(H6-,53,54,55,56,57,58,59,60,61)/p+1/t33-,34-,35-,39-,40-,41-,42+,43+,44+,45-,46-,47-,49-,50-,51-/m1/s1",O=C(C=Cc1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc(-c3[o+]c4cc(O)cc(O[C@@H]5O[C@H](COC(=O)C=Cc6ccc(O)c(O)c6)[C@@H](O)[C@H](O)[C@H]5O)c4cc3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C51H53O28+,,1113.27178747609,CMHKKALEZOJWDP,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Gentiana triflora,485204.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Gentiana'],['Gentiana triflora'],4,2,7.201714515686035 1660,6275,-1,,,,0.0,MS1_match,RKMQRPYLPSKVNS-UHFFFAOYSA-N,"InChI=1S/C6H10O4/c1-10-6(9)3-2-5(8)4-7/h7H,2-4H2,1H3",COC(=O)CCC(=O)CO,C6H10O4,pos_2MHNH3,146.0579088,RKMQRPYLPSKVNS,Fatty acids,Fatty Acids and Conjugates,,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 1661,6273,-1,,,,0.3551589,ISDB,OWDQPILTDJLGCN-UHFFFAOYSA-N,"InChI=1S/C19H23NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,10,12-13,22H,6-9H2,1-3H3",COC1=CC23CCN(C)C(Cc4ccc(OC)c(O)c42)C3CC1=O,C19H23NO4,,329.162708216,OWDQPILTDJLGCN,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum tuberiferum,338809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum tuberiferum'],6,0,7.4206355810165405 1662,6273,-1,,,,0.3551589,ISDB,OWDQPILTDJLGCN-WTOJCKNJSA-N,"InChI=1S/C19H23NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,10,12-13,22H,6-9H2,1-3H3/t12-,13-,19+/m0/s1",COC1=C[C@@]23CCN(C)[C@@H](Cc4ccc(OC)c(O)c42)[C@@H]3CC1=O,C19H23NO4,,329.162708216,OWDQPILTDJLGCN,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum urbainii,753952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum urbainii'],6,0,7.4206355810165405 1663,6272,-1,,,,0.46198723,ISDB,BNYDLXBTNLOWPZ-YYCMBSPASA-N,"InChI=1S/C42H46O24/c1-14-28(50)32(54)35(57)40(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)38(31(27)53)65-42-39(66-41-36(58)33(55)29(51)24(12-43)63-41)34(56)30(52)25(64-42)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15/h2-11,14,24-25,28-30,32-36,39-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24-,25+,28-,29+,30+,32+,33-,34-,35-,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)c(O)c5)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@H](O)[C@H]1O,C42H46O24,,934.2379023520002,BNYDLXBTNLOWPZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,7.847948908805847 1664,6271,1000,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,HVCNSAJVIFXBHU-UHFFFAOYSA-N,"InChI=1S/C5H8O4/c6-3-4(7)1-2-5(8)9/h6H,1-3H2,(H,8,9)",O=C(O)CCC(=O)CO,C5H8O4,pos_2MH,132.042258736,HVCNSAJVIFXBHU,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 1665,6269,-1,,,,0.0,MS1_match,AAZUTFXRXPQDIM-XAYKYMFXSA-N,"InChI=1S/C51H82O20/c1-22-24-10-13-50(7)31(9-8-25-26-18-47(3,4)14-16-51(26,46(62)63)17-15-49(25,50)6)48(24,5)12-11-28(22)67-45-41(33(55)27(53)20-64-45)71-44-39(61)40(32(54)23(2)66-44)70-42-37(59)35(57)30(21-65-42)69-43-38(60)36(58)34(56)29(19-52)68-43/h8,22-24,26-45,52-61H,9-21H2,1-7H3,(H,62,63)/t22-,23+,24-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35-,36+,37-,38-,39-,40-,41-,42+,43+,44+,45+,48+,49+,50+,51-/m0/s1",C[C@@H]1[C@H](O[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@H](C)[C@@H](O)[C@H](O[C@H]3OC[C@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H]3O)[C@@H]2O)CC[C@]2(C)[C@H]1CC[C@]1(C)[C@H]2CC=C2[C@H]3CC(C)(C)CC[C@]3(C(=O)O)CC[C@]21C,C51H82O20,pos_2_2proton,1014.539945024,AAZUTFXRXPQDIM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 1666,6268,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.56472963,ISDB,QSHUUGSBRMSXKV-UHFFFAOYSA-N,"InChI=1S/C15H22O5/c1-8(2)5-6-15(20)13(18)11(12(17)14(15)19)10(16)7-9(3)4/h5,9,14,17,19-20H,6-7H2,1-4H3",CC(C)=CCC1(O)C(=O)C(C(=O)CC(C)C)=C(O)C1O,C15H22O5,,282.146723804,QSHUUGSBRMSXKV,Polyketides,Meroterpenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),Humulus lupulus,84020.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Humulus'],['Humulus lupulus'],4,3,7.758918523788452 1667,6267,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.37395552,ISDB,FHSVMYDBGPVTTJ-UHFFFAOYSA-N,"InChI=1S/C27H48O3/c1-16(2)14-24(29)25(30)17(3)21-8-9-22-20-7-6-18-15-19(28)10-12-26(18,4)23(20)11-13-27(21,22)5/h16-25,28-30H,6-15H2,1-5H3",CC(C)CC(O)C(O)C(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C,C27H48O3,,420.360345396,FHSVMYDBGPVTTJ,Terpenoids,Steroids,Cholestane steroids,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,0,5.495822072029114 1668,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 1669,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,0,8.0 1670,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 1671,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 1672,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 1673,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,0,8.0 1674,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 1675,6266,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton2acetonitrile,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 1676,6266,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_2_2proton2acetonitrile,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 1677,6266,-1,,,,0.0,MS1_match,JIAZWFZSNYBPNC-UHFFFAOYSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)32(48)34(51-21)53-35(49)41-16-14-36(2,3)18-23(41)22-8-9-26-37(4)12-11-27(52-33-31(47)29(45)24(43)19-50-33)38(5,20-42)25(37)10-13-40(26,7)39(22,6)15-17-41/h8,21,23-34,42-48H,9-20H2,1-7H3",CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC4(C)C2(C)CC3)C(O)C(O)C1O,C41H66O12,pos_2_2proton2acetonitrile,750.455427552,JIAZWFZSNYBPNC,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 1678,6266,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_2_2proton2acetonitrile,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 1679,6266,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_2_2proton2acetonitrile,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 1680,6265,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,AQOVEYNSQFBSQX-STMBSLSDSA-N,"InChI=1S/C16H20O5/c1-4-13(11-17)16(18)21-9-5-6-12-7-8-14(19-2)15(10-12)20-3/h4-8,10,17H,9,11H2,1-3H3/b6-5+,13-4-",C/C=C(/CO)C(=O)OC/C=C/c1ccc(OC)c(OC)c1,C16H20O5,pos_2MNa,292.13107374,AQOVEYNSQFBSQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 1681,6263,-1,,,,0.6767511,ISDB,STIYXYABWPDGCS-PRLTYNAASA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(17)16(4)8-7-12-10(2)11(3)18-15(12)14(9)16/h5,10,12-15,17H,3,6-8H2,1-2,4H3/t10-,12+,13-,14-,15+,16+/m1/s1",C=C1O[C@H]2[C@@H](CC[C@@]3(C)[C@H](O)CC=C(C)[C@H]23)[C@@H]1C,C16H24O2,,248.177630008,STIYXYABWPDGCS,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Artemisia inculta,969157.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia inculta'],4,0,6.7070043087005615 1682,6261,-1,,,,0.40630248,ISDB,PMIUOPDTARUOHW-USFRMQJTSA-N,"InChI=1S/C23H22O12/c1-31-10-5-3-9(4-6-10)14-8-12(25)15-11(24)7-13(26)19(20(15)33-14)34-23-18(29)16(27)17(28)21(35-23)22(30)32-2/h3-8,16-18,21,23-24,26-29H,1-2H3/t16-,17-,18+,21-,23+/m0/s1",COC(=O)[C@H]1O[C@@H](Oc2c(O)cc(O)c3c(=O)cc(-c4ccc(OC)cc4)oc23)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O12,,490.111126144,PMIUOPDTARUOHW,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Helicteres angustifolia,283046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Helicteres'],['Helicteres angustifolia'],4,0,5.625209927558899 1683,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-UHFFFAOYSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3",CC(=O)OCC1OC(Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C23H22O13,,506.106040764,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Hymenoxys hoopesii,950020.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Hymenoxys'],['Hymenoxys hoopesii'],4,3,9.240292072296143 1684,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-UHFFFAOYSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3",CC(=O)OCC1OC(Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C23H22O13,,506.106040764,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Peucedanum ostruthium,435990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Peucedanum'],['Peucedanum ostruthium'],4,3,9.240292072296143 1685,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Morus bombycis,210686.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus bombycis'],4,3,9.240292072296143 1686,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cyclamen persicum,477897.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Cyclamen'],['Cyclamen persicum'],4,3,9.240292072296143 1687,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Arnica longifolia,384106.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Madieae'],['Arnica'],['Arnica longifolia'],4,3,9.240292072296143 1688,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-QZGPLKIZSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17+,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],4,3,9.240292072296143 1689,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Stachyurus himalaicus,1015897.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Crossosomatales'],['Stachyuraceae'],['Unknown'],['Stachyurus'],['Stachyurus himalaicus'],4,3,9.240292072296143 1690,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-QZGPLKIZSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17+,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nymphaea odorata,583519.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Nymphaeales'],['Nymphaeaceae'],['Unknown'],['Nymphaea'],['Nymphaea odorata'],4,3,9.240292072296143 1691,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Senecio mairetianus,136447.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Senecio'],['Senecio mairetianus'],4,3,9.240292072296143 1692,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Heterophyllaea pustulata,1041897.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coussareeae'],['Heterophyllaea'],['Heterophyllaea pustulata'],4,3,9.240292072296143 1693,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Sarcopyramis bodinieri,7057904.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Melastomataceae'],['Unknown'],['Sarcopyramis'],['Sarcopyramis bodinieri'],4,3,9.240292072296143 1694,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Morus indica,307703.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus indica'],4,3,9.240292072296143 1695,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Marrubium velutinum,6081214.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Marrubieae'],['Marrubium'],['Marrubium velutinum'],4,3,9.240292072296143 1696,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,3,9.240292072296143 1697,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Morus australis,210689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus australis'],4,3,9.240292072296143 1698,6257,373,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.935073,ISDB,IGLUNMMNDNWZOA-LNNZMUSMSA-N,"InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O13,,506.10604076399983,IGLUNMMNDNWZOA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Petasites japonicus,47000.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Petasites'],['Petasites japonicus'],4,3,9.240292072296143 1699,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 1700,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana amurensis,245959.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana amurensis'],6,2,7.0 1701,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 1702,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 1703,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana ficariifolia,5746450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana ficariifolia'],6,2,7.0 1704,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 1705,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 1706,6256,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,2,7.0 1707,6254,958,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,NCIGKQNGSNDBBN-CKSGFJDPSA-N,"InChI=1S/C23H22O12/c1-8(24)33-7-16-19(30)20(31)21(32)23(35-16)18-13(28)5-12(27)17-14(29)6-15(34-22(17)18)9-2-3-10(25)11(26)4-9/h2-6,16,19-21,23,25-28,30-32H,7H2,1H3/t16-,19-,20+,21-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc23)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_sodium,490.111126144,NCIGKQNGSNDBBN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius,1011767.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Unknown'],6,3,7.5 1708,6254,958,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,NCIGKQNGSNDBBN-PDZUXIDASA-N,"InChI=1S/C23H22O12/c1-8(24)33-7-16-19(30)20(31)21(32)23(35-16)18-13(28)5-12(27)17-14(29)6-15(34-22(17)18)9-2-3-10(25)11(26)4-9/h2-6,16,19-21,23,25-28,30-32H,7H2,1H3/t16-,19+,20-,21+,23-/m0/s1",CC(=O)OC[C@@H]1O[C@@H](c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc23)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_sodium,490.111126144,NCIGKQNGSNDBBN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,3,7.5 1709,6251,330,Terpenoids,Monoterpenoids,Pinane monoterpenoids,0.42160156,ISDB,TVGPYTOYKLZBPA-UHFFFAOYSA-N,"InChI=1S/C15H24O2/c1-10(2)7-14(16)17-9-11-5-6-12-8-13(11)15(12,3)4/h5,10,12-13H,6-9H2,1-4H3",CC(C)CC(=O)OCC1=CCC2CC1C2(C)C,C15H24O2,,236.177630008,TVGPYTOYKLZBPA,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,9.186406254768372 1710,6249,-1,,,,0.0,MS1_match,WEAUPFXXCUHVAE-MKMMZYOTSA-N,"InChI=1S/C26H28O11/c1-3-11(2)26(34)37-25-22(33)21(32)18(10-27)36-24(25)20-15(30)8-14(29)19-16(31)9-17(35-23(19)20)12-4-6-13(28)7-5-12/h4-9,11,18,21-22,24-25,27-30,32-33H,3,10H2,1-2H3/t11-,18+,21+,22-,24-,25+/m0/s1",CC[C@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12,C26H28O11,pos_1_1proton1ammonium,516.163161716,WEAUPFXXCUHVAE,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 1711,6249,-1,,,,0.0,MS1_match,WEAUPFXXCUHVAE-MKMMZYOTSA-N,"InChI=1S/C26H28O11/c1-3-11(2)26(34)37-25-22(33)21(32)18(10-27)36-24(25)20-15(30)8-14(29)19-16(31)9-17(35-23(19)20)12-4-6-13(28)7-5-12/h4-9,11,18,21-22,24-25,27-30,32-33H,3,10H2,1-2H3/t11-,18+,21+,22-,24-,25+/m0/s1",CC[C@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12,C26H28O11,pos_1_1proton1ammonium,516.163161716,WEAUPFXXCUHVAE,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 1712,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,1,6.5 1713,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,1,6.5 1714,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,1,6.5 1715,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 1716,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,1,6.5 1717,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NIDSBIYSGNHVDL-UHFFFAOYSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)",O=C(C=Cc1ccc(O)cc1)OC(C(=O)O)C(O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,1,6.5 1718,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 1719,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 1720,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,1,6.5 1721,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,1,6.5 1722,6245,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton1methanol,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 1723,6244,-1,,,,0.0,MS1_match,OXPXIQPEHBLBIX-VMOHQDNESA-N,"InChI=1S/C43H70O16/c1-19-15-22(33(38(5,6)52)55-20(2)45)59-43(53)32(19)39(7)13-14-42-18-41(42)12-11-26(57-34-30(50)27(47)21(46)17-54-34)37(3,4)24(41)9-10-25(42)40(39,8)36(43)58-35-31(51)29(49)28(48)23(16-44)56-35/h19,21-36,44,46-53H,9-18H2,1-8H3/t19-,21-,22-,23-,24+,25+,26+,27+,28-,29+,30-,31-,32-,33+,34+,35+,36-,39-,40-,41-,42+,43+/m1/s1",CC(=O)O[C@@H]([C@H]1C[C@@H](C)[C@H]2[C@](O)(O1)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C)C(C)(C)O,C43H70O16,pos_2_2sodium,842.46638616,OXPXIQPEHBLBIX,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 1724,6242,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,1,7.5 1725,6242,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 1726,6242,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,1,7.5 1727,6242,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,1,7.5 1728,6242,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 1729,6242,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,1,7.5 1730,6240,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.3239648,ISDB,,,,,,,KAHFDJBGOVQLRU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2958592176437378 1731,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1732,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 1733,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 1734,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 1735,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1736,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 1737,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 1738,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 1739,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_1proton,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 1740,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 1741,6236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 1742,6229,-1,,,,0.0,MS1_match,ZWPGENPRTLGXDK-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-26(41)14-19(2)31(38)42)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,42)(H,39,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,ZWPGENPRTLGXDK,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 1743,6229,-1,,,,0.0,MS1_match,ZWPGENPRTLGXDK-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-26(41)14-19(2)31(38)42)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,42)(H,39,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,ZWPGENPRTLGXDK,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 1744,6229,-1,,,,0.0,MS1_match,ZWPGENPRTLGXDK-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-26(41)14-19(2)31(38)42)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,42)(H,39,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,ZWPGENPRTLGXDK,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 1745,6229,-1,,,,0.0,MS1_match,ZWPGENPRTLGXDK-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-26(41)14-19(2)31(38)42)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,42)(H,39,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,ZWPGENPRTLGXDK,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,0,6.0 1746,6229,-1,,,,0.0,MS1_match,ZWPGENPRTLGXDK-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-26(41)14-19(2)31(38)42)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,42)(H,39,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,ZWPGENPRTLGXDK,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 1747,6229,-1,,,,0.0,MS1_match,ZWPGENPRTLGXDK-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-26(41)14-19(2)31(38)42)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,42)(H,39,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,ZWPGENPRTLGXDK,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium delavayi,70138.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium delavayi'],6,0,6.0 1748,6229,-1,,,,0.0,MS1_match,ZWPGENPRTLGXDK-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-26(41)14-19(2)31(38)42)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,42)(H,39,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)C[C@@H](C)C(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,ZWPGENPRTLGXDK,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium umbrosum,5737858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium umbrosum'],6,0,6.0 1749,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-OWBGXFSJSA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19?,21-,22?,24?,25?,27?,28?,29?,30?,33?,34?,35-,36?,37?/m1/s1",CCN1CC2(COC(=O)c3ccccc3NC(=O)C(C)CC(N)=O)CCC(OC)C34C5C[C@@H]6C(OC)C[C@@](O)(C5C6OC)C(O)(C(OC)C23)C14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 1750,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-IGHBFZKASA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19?,21-,22?,24?,25-,27?,28+,29?,30+,33+,34?,35-,36?,37?/m1/s1",CCN1CC2(COC(=O)c3ccccc3NC(=O)C(C)CC(N)=O)CC[C@@H](OC)C34C5C[C@@H]6C(OC)C[C@@](O)(C5[C@H]6OC)C(O)([C@@H](OC)C23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 1751,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-OWBGXFSJSA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19?,21-,22?,24?,25?,27?,28?,29?,30?,33?,34?,35-,36?,37?/m1/s1",CCN1CC2(COC(=O)c3ccccc3NC(=O)C(C)CC(N)=O)CCC(OC)C34C5C[C@@H]6C(OC)C[C@@](O)(C5C6OC)C(O)(C(OC)C23)C14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 1752,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-IGHBFZKASA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19?,21-,22?,24?,25-,27?,28+,29?,30+,33+,34?,35-,36?,37?/m1/s1",CCN1CC2(COC(=O)c3ccccc3NC(=O)C(C)CC(N)=O)CC[C@@H](OC)C34C5C[C@@H]6C(OC)C[C@@](O)(C5[C@H]6OC)C(O)([C@@H](OC)C23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,0,6.0 1753,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-OWBGXFSJSA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19?,21-,22?,24?,25?,27?,28?,29?,30?,33?,34?,35-,36?,37?/m1/s1",CCN1CC2(COC(=O)c3ccccc3NC(=O)C(C)CC(N)=O)CCC(OC)C34C5C[C@@H]6C(OC)C[C@@](O)(C5C6OC)C(O)(C(OC)C23)C14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 1754,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)[C@H](C)CC(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium delavayi,70138.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium delavayi'],6,0,6.0 1755,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-CRNWGPEESA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)[C@H](C)CC(N)=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium umbrosum,5737858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium umbrosum'],6,0,6.0 1756,6229,-1,,,,0.0,MS1_match,NXAZXMKMGPWXII-WJBUYGCISA-N,"InChI=1S/C37H53N3O10/c1-7-40-17-34(18-50-32(43)20-10-8-9-11-23(20)39-31(42)19(2)14-26(38)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)40)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H2,38,41)(H,39,42)/t19-,21-,22-,24+,25-,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)[C@H](C)CC(N)=O)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C37H53N3O10,pos_1_1sodium1acetonitrile,699.373094896,NXAZXMKMGPWXII,Alkaloids,Tyrosine alkaloids,Hasubanan alkaloids,Delphinium dictyocarpum,6131639.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium dictyocarpum'],6,0,6.0 1757,6228,-1,,,,0.3383567,ISDB,WURUSNYKHDFEDN-JJOBWUIXSA-N,"InChI=1S/C30H39NO3/c1-7-20(3)25-21(4)16-29(5)15-19(2)13-14-24(29)26(25)27(32)23-18-30(34-6,31-28(23)33)17-22-11-9-8-10-12-22/h7-12,16,18-19,24-26H,13-15,17H2,1-6H3,(H,31,33)/b20-7+/t19-,24+,25-,26+,29+,30+/m1/s1",C/C=C(\C)[C@@H]1C(C)=C[C@]2(C)C[C@H](C)CC[C@H]2[C@@H]1C(=O)C1=C[C@](Cc2ccccc2)(OC)NC1=O,C30H39NO3,,461.292994108,WURUSNYKHDFEDN,Amino acids and Peptides,Cyclic polyketides,3-Decalinoyltetramic acids,Chaetomium globosum,474230.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Sordariales'],['Chaetomiaceae'],['Unknown'],['Chaetomium'],['Chaetomium globosum'],1,0,2.3534268140792847 1758,6228,-1,,,,0.3383567,ISDB,WURUSNYKHDFEDN-JJOBWUIXSA-N,"InChI=1S/C30H39NO3/c1-7-20(3)25-21(4)16-29(5)15-19(2)13-14-24(29)26(25)27(32)23-18-30(34-6,31-28(23)33)17-22-11-9-8-10-12-22/h7-12,16,18-19,24-26H,13-15,17H2,1-6H3,(H,31,33)/b20-7+/t19-,24+,25-,26+,29+,30+/m1/s1",C/C=C(\C)[C@@H]1C(C)=C[C@]2(C)C[C@H](C)CC[C@H]2[C@@H]1C(=O)C1=C[C@](Cc2ccccc2)(OC)NC1=O,C30H39NO3,,461.292994108,WURUSNYKHDFEDN,Amino acids and Peptides,Cyclic polyketides,3-Decalinoyltetramic acids,Chaetomium olivaceum,474230.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Sordariales'],['Chaetomiaceae'],['Unknown'],['Chaetomium'],['Chaetomium globosum'],1,0,2.3534268140792847 1759,6227,248,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QUKURLODOVRHQB-CSIVPCFASA-N,"InChI=1S/C23H37NO9/c1-24-7-20(8-31-2)10(25)5-11(32-3)22-9-6-21(29)17(26)12(9)23(30,19(28)18(21)27)13(16(22)24)14(33-4)15(20)22/h9-19,25-30H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14+,15-,16-,17-,18+,19+,20+,21-,22+,23-/m1/s1",COC[C@]12CN(C)[C@@H]3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](O)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2O,C23H37NO9,pos_1_1proton1methanol,471.2468317639998,QUKURLODOVRHQB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 1760,6225,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.54779613,ISDB,YXAMANJJQIUXMQ-UNRHHUQTSA-N,"InChI=1S/C23H20O13/c1-8(24)33-20-18(29)19(30)23(36-21(20)22(31)32)35-15-4-9(2-3-11(15)26)14-7-13(28)17-12(27)5-10(25)6-16(17)34-14/h2-7,18-21,23,25-27,29-30H,1H3,(H,31,32)/t18-,19-,20+,21+,23-/m1/s1",CC(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](Oc2cc(-c3cc(=O)c4c(O)cc(O)cc4o3)ccc2O)O[C@@H]1C(=O)O,C23H20O13,,504.0903907,YXAMANJJQIUXMQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Salvia,374096.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Unknown'],4,3,7.6911845207214355 1761,6225,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.54779613,ISDB,YXAMANJJQIUXMQ-ZFVIQDPVSA-N,"InChI=1S/C23H20O13/c1-8(24)33-20-18(29)19(30)23(36-21(20)22(31)32)35-15-4-9(2-3-11(15)26)14-7-13(28)17-12(27)5-10(25)6-16(17)34-14/h2-7,18-21,23,25-27,29-30H,1H3,(H,31,32)/t18-,19-,20+,21-,23-/m1/s1",CC(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](Oc2cc(-c3cc(=O)c4c(O)cc(O)cc4o3)ccc2O)O[C@H]1C(=O)O,C23H20O13,,504.09039069999983,YXAMANJJQIUXMQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Rosmarinus officinalis,778824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia rosmarinus'],4,3,7.6911845207214355 1762,6220,-1,,,,0.0,MS1_match,JMSVCTWVEWCHDZ-UHFFFAOYSA-N,"InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12)",COc1cc(C(=O)O)cc(OC)c1O,C9H10O5,pos_1_1proton1methanol,198.05282342,JMSVCTWVEWCHDZ,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Microtropis fokienensis,1015845.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis fokienensis'],6,0,6.0 1763,6220,-1,,,,0.0,MS1_match,PAFLSMZLRSPALU-QMMMGPOBSA-N,"InChI=1S/C9H10O5/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-3,8,10-12H,4H2,(H,13,14)/t8-/m0/s1",O=C(O)[C@@H](O)Cc1ccc(O)c(O)c1,C9H10O5,pos_1_1proton1methanol,198.05282342,PAFLSMZLRSPALU,Shikimates and Phenylpropanoids,,,Ranunculus lanuginosus,714306.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus lanuginosus'],6,0,6.0 1764,6218,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 1765,6218,-1,,,,0.0,MS1_match,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,6.0 1766,6218,-1,,,,0.0,MS1_match,VRYWDBDPXMHHGE-HRPPYHBASA-N,"InChI=1S/C33H40O20/c1-10-19(38)23(42)26(45)31(47-10)48-13-6-14(37)18-15(7-13)49-28(11-2-4-12(36)5-3-11)29(22(18)41)52-33-30(25(44)21(40)17(9-35)51-33)53-32-27(46)24(43)20(39)16(8-34)50-32/h2-7,10,16-17,19-21,23-27,30-40,42-46H,8-9H2,1H3/t10-,16+,17+,19-,20+,21-,23+,24-,25-,26+,27+,30+,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,pos_1_sodium,756.21129368,VRYWDBDPXMHHGE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella damascena,387814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella damascena'],6,0,6.0 1767,6217,-1,,,,0.0,MS1_match,NCIGKQNGSNDBBN-CKSGFJDPSA-N,"InChI=1S/C23H22O12/c1-8(24)33-7-16-19(30)20(31)21(32)23(35-16)18-13(28)5-12(27)17-14(29)6-15(34-22(17)18)9-2-3-10(25)11(26)4-9/h2-6,16,19-21,23,25-28,30-32H,7H2,1H3/t16-,19-,20+,21-,23+/m1/s1",CC(=O)OC[C@H]1O[C@@H](c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc23)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_1proton1ammonium,490.111126144,NCIGKQNGSNDBBN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius,1011767.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Unknown'],6,0,6.0 1768,6217,-1,,,,0.0,MS1_match,NCIGKQNGSNDBBN-PDZUXIDASA-N,"InChI=1S/C23H22O12/c1-8(24)33-7-16-19(30)20(31)21(32)23(35-16)18-13(28)5-12(27)17-14(29)6-15(34-22(17)18)9-2-3-10(25)11(26)4-9/h2-6,16,19-21,23,25-28,30-32H,7H2,1H3/t16-,19+,20-,21+,23-/m0/s1",CC(=O)OC[C@@H]1O[C@@H](c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc23)[C@H](O)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_1proton1ammonium,490.111126144,NCIGKQNGSNDBBN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 1769,6217,-1,,,,0.0,MS1_match,MWEQHAGXLGTSKL-OPCQMSRDSA-N,"InChI=1S/C23H22O12/c1-9(25)32-22-19(31)17(29)15(8-24)34-23(22)35-21-18(30)16-13(28)6-12(27)7-14(16)33-20(21)10-2-4-11(26)5-3-10/h2-7,15,17,19,22-24,26-29,31H,8H2,1H3/t15-,17-,19+,22-,23+/m1/s1",CC(=O)O[C@H]1[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@H](CO)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_1proton1ammonium,490.1111261439999,MWEQHAGXLGTSKL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1770,6217,-1,,,,0.0,MS1_match,MWEQHAGXLGTSKL-OPCQMSRDSA-N,"InChI=1S/C23H22O12/c1-9(25)32-22-19(31)17(29)15(8-24)34-23(22)35-21-18(30)16-13(28)6-12(27)7-14(16)33-20(21)10-2-4-11(26)5-3-10/h2-7,15,17,19,22-24,26-29,31H,8H2,1H3/t15-,17-,19+,22-,23+/m1/s1",CC(=O)O[C@H]1[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@H](CO)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_1proton1ammonium,490.1111261439999,MWEQHAGXLGTSKL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1771,6217,-1,,,,0.0,MS1_match,MWEQHAGXLGTSKL-OPCQMSRDSA-N,"InChI=1S/C23H22O12/c1-9(25)32-22-19(31)17(29)15(8-24)34-23(22)35-21-18(30)16-13(28)6-12(27)7-14(16)33-20(21)10-2-4-11(26)5-3-10/h2-7,15,17,19,22-24,26-29,31H,8H2,1H3/t15-,17-,19+,22-,23+/m1/s1",CC(=O)O[C@H]1[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@H](CO)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_1proton1ammonium,490.1111261439999,MWEQHAGXLGTSKL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1772,6217,-1,,,,0.0,MS1_match,MWEQHAGXLGTSKL-OPCQMSRDSA-N,"InChI=1S/C23H22O12/c1-9(25)32-22-19(31)17(29)15(8-24)34-23(22)35-21-18(30)16-13(28)6-12(27)7-14(16)33-20(21)10-2-4-11(26)5-3-10/h2-7,15,17,19,22-24,26-29,31H,8H2,1H3/t15-,17-,19+,22-,23+/m1/s1",CC(=O)O[C@H]1[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@H](CO)[C@@H](O)[C@@H]1O,C23H22O12,pos_1_1proton1ammonium,490.1111261439999,MWEQHAGXLGTSKL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 1773,6214,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.77269787,ISDB,ZCCLDKGWJIREQF-PDBXOOCHSA-N,"InChI=1S/C21H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h3-4,6-7,9-10,20,22-23H,2,5,8,11-19H2,1H3/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO,C21H36O4,,352.261359632,ZCCLDKGWJIREQF,Fatty acids,Glycerolipids,Monoacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,3,8.590791463851929 1774,6212,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.20945708,ISDB,,,,,,,ZKJDJIORHUYWFV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8378283381462097 1775,6205,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NRNLHCNVJHJROX-SKXWEYSTSA-N,"InChI=1S/C30H34O17/c31-11-19-23(37)25(39)28(42)30(45-19)47-22(36)8-4-14-2-6-18(17(34)10-14)44-29-27(41)26(40)24(38)20(46-29)12-43-21(35)7-3-13-1-5-15(32)16(33)9-13/h1-10,19-20,23-34,37-42H,11-12H2/b7-3+,8-4+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O17,pos_1_1proton1ammonium,666.1795996280001,NRNLHCNVJHJROX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 1776,6205,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QZBUECAZYHVZBH-SKXWEYSTSA-N,"InChI=1S/C30H34O17/c31-11-19-23(37)25(39)28(42)30(45-19)47-22(36)8-4-14-2-6-16(33)18(10-14)44-29-27(41)26(40)24(38)20(46-29)12-43-21(35)7-3-13-1-5-15(32)17(34)9-13/h1-10,19-20,23-34,37-42H,11-12H2/b7-3+,8-4+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O17,pos_1_1proton1ammonium,666.1795996280001,QZBUECAZYHVZBH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 1777,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,9.5 1778,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,JIAZWFZSNYBPNC-UHFFFAOYSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)32(48)34(51-21)53-35(49)41-16-14-36(2,3)18-23(41)22-8-9-26-37(4)12-11-27(52-33-31(47)29(45)24(43)19-50-33)38(5,20-42)25(37)10-13-40(26,7)39(22,6)15-17-41/h8,21,23-34,42-48H,9-20H2,1-7H3",CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC4(C)C2(C)CC3)C(O)C(O)C1O,C41H66O12,pos_2_2proton,750.455427552,JIAZWFZSNYBPNC,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,9.5 1779,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,9.5 1780,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_2_2proton,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,9.5 1781,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,3,9.5 1782,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,9.5 1783,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 1784,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_2_2proton,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,9.5 1785,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 1786,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_2_2proton,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,9.5 1787,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,9.5 1788,6202,769,Alkaloids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_2_2proton,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,3,9.5 1789,6200,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94979936,ISDB,FCJIWTZAADYCGI-LUFRPPBASA-N,"InChI=1S/C20H24O12/c21-10-6-28-19(17(26)14(10)23)29-7-12-15(24)16(25)18(27)20(32-12)30-9-3-1-8-2-4-13(22)31-11(8)5-9/h1-5,10,12,14-21,23-27H,6-7H2/t10-,12-,14+,15-,16+,17-,18-,19+,20-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C20H24O12,,456.126776208,FCJIWTZAADYCGI,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Stellera chamaejasme,191882.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Stellera'],['Stellera chamaejasme'],4,1,8.299197435379028 1790,6198,861,Shikimates and Phenylpropanoids,Aromatic polyketides,Griseofulvins,0.21900472,ISDB,DDUHZTYCFQRHIY-RBHXEPJQSA-N,"InChI=1S/C17H17ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h6-8H,5H2,1-4H3/t8-,17+/m1/s1",COC1=CC(=O)C[C@@H](C)[C@]12Oc1c(Cl)c(OC)cc(OC)c1C2=O,C17H17ClO6,,352.07136594400004,DDUHZTYCFQRHIY,Polyketides,Aromatic polyketides,Griseofulvins,Melodinus khasianus,6067868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Melodineae'],['Melodinus'],['Melodinus khasianus'],4,3,6.3760188817977905 1791,6198,861,Shikimates and Phenylpropanoids,Aromatic polyketides,Griseofulvins,0.21900472,ISDB,DDUHZTYCFQRHIY-RBHXEPJQSA-N,"InChI=1S/C17H17ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h6-8H,5H2,1-4H3/t8-,17+/m1/s1",COC1=CC(=O)C[C@@H](C)[C@]12Oc1c(Cl)c(OC)cc(OC)c1C2=O,C17H17ClO6,,352.07136594400004,DDUHZTYCFQRHIY,Polyketides,Aromatic polyketides,Griseofulvins,Melodinus cochinchinensis,669208.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Melodineae'],['Melodinus'],['Melodinus cochinchinensis'],4,3,6.3760188817977905 1792,6197,867,,,,0.20807935,ISDB,,,,,,,JPKGNFPMXAWCGK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8323174118995667 1793,6188,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.3490072,ISDB,,,,,,,HBLASUZVCZYBQF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.396028757095337 1794,6187,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.6397179,ISDB,LSGRYBYDAOHTMR-FTCIMYNOSA-N,"InChI=1S/C33H38O21/c1-9-20(38)22(40)26(44)31(49-9)48-8-18-21(39)24(42)29(54-32-27(45)23(41)25(43)28(53-32)30(46)47)33(52-18)50-11-5-14(36)19-15(37)7-16(51-17(19)6-11)10-2-3-12(34)13(35)4-10/h2-7,9,18,20-29,31-36,38-45H,8H2,1H3,(H,46,47)/t9-,18+,20-,21+,22+,23-,24-,25-,26+,27+,28-,29+,31+,32-,33+/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)[C@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H38O21,,770.190558236,LSGRYBYDAOHTMR,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Robinia pseudoacacia,928416.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Robinieae'],['Robinia'],['Robinia pseudoacacia'],4,2,7.558871507644653 1795,6182,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.6630553,ISDB,BOKVLBSSPUTWLV-INIZCTEOSA-N,"InChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3/t16-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(O)cc1)N(C)CC2,C18H21NO3,,299.152143532,BOKVLBSSPUTWLV,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,3,12.152221202850342 1796,6180,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.7380449,ISDB,KQWJDIAXCWPNIF-LMSPLNQWSA-N,"InChI=1S/C33H38O22/c1-8-17(37)20(40)23(43)32(50-8)54-28-25(45)29(30(47)48)55-31(26(28)46)49-7-15-18(38)21(41)24(44)33(53-15)52-14-6-10(34)5-13-16(14)19(39)22(42)27(51-13)9-2-3-11(35)12(36)4-9/h2-6,8,15,17-18,20-21,23-26,28-29,31-38,40-46H,7H2,1H3,(H,47,48)/t8-,15+,17-,18+,20+,21-,23+,24+,25-,26+,28-,29-,31+,32-,33+/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OC[C@H]3O[C@@H](Oc4cc(O)cc5oc(-c6ccc(O)c(O)c6)c(O)c(=O)c45)[C@H](O)[C@@H](O)[C@@H]3O)O[C@H](C(=O)O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H38O22,,786.185472856,KQWJDIAXCWPNIF,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Pedicularis verticillata,980478.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Pedicularideae'],['Pedicularis'],['Pedicularis verticillata'],4,3,8.452179670333862 1797,6179,113,,,,0.28584996,ISDB,,,,,,,DDGBIAABCSGSND,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1433998346328735 1798,6178,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.40816078,ISDB,VRYWDBDPXMHHGE-HRPPYHBASA-N,"InChI=1S/C33H40O20/c1-10-19(38)23(42)26(45)31(47-10)48-13-6-14(37)18-15(7-13)49-28(11-2-4-12(36)5-3-11)29(22(18)41)52-33-30(25(44)21(40)17(9-35)51-33)53-32-27(46)24(43)20(39)16(8-34)50-32/h2-7,10,16-17,19-21,23-27,30-40,42-46H,8-9H2,1H3/t10-,16+,17+,19-,20+,21-,23+,24-,25-,26+,27+,30+,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,,756.21129368,VRYWDBDPXMHHGE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella damascena,387814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella damascena'],6,3,9.132643103599548 1799,6175,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.67390805,ISDB,ZBKFZIUKXTWQTP-QGZVFWFLSA-N,"InChI=1S/C19H23NO3/c1-20-9-8-14-11-18(22-2)19(23-3)12-16(14)17(20)10-13-4-6-15(21)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m1/s1",COc1cc2c(cc1OC)[C@@H](Cc1ccc(O)cc1)N(C)CC2,C19H23NO3,,313.167793596,ZBKFZIUKXTWQTP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,10.195632219314575 1800,6175,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.67390805,ISDB,ZBKFZIUKXTWQTP-QGZVFWFLSA-N,"InChI=1S/C19H23NO3/c1-20-9-8-14-11-18(22-2)19(23-3)12-16(14)17(20)10-13-4-6-15(21)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m1/s1",COc1cc2c(cc1OC)[C@@H](Cc1ccc(O)cc1)N(C)CC2,C19H23NO3,,313.167793596,ZBKFZIUKXTWQTP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,3,10.195632219314575 1801,6173,258,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ULRBKGCIGBUVLG-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-5-6-3-8(11)10(2)7(6)4-12-9(5)13-10/h6-9,11H,1,3-4H2,2H3",C=C1C2OCC3C1CC(O)C3(C)O2,C10H14O3,pos_2MCH3CNNa,182.094294308,ULRBKGCIGBUVLG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 1802,6173,258,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,IBWYIXZIEIPGJL-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-7-5-13-10(6-12)8(4-11)2-3-9(7)10/h2,9,11-12H,1,3-6H2",C=C1COC2(CO)C(CO)=CCC12,C10H14O3,pos_2MCH3CNNa,182.094294308,IBWYIXZIEIPGJL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 1803,6172,109,Terpenoids,Diterpenoids,Estrane steroids,0.57136303,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.785452127456665 1804,6171,970,Fatty acids,Octadecanoids,Other Octadecanoids,0.41685772,ISDB,KICRKYKTMPUVKC-OZSKJFCKSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-7-8-11-14-17(19)15-12-9-10-13-16-18(20)21/h2,7-8,17,19H,1,3-6,9-10,12-13,15-16H2,(H,20,21)/b8-7+/t17-/m0/s1",C=CCCCC/C=C/C#C[C@H](O)CCCCCCC(=O)O,C18H28O3,,292.203844756,KICRKYKTMPUVKC,Fatty acids,Octadecanoids,Other Octadecanoids,Iodina rhombifolia,124280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Santalales'],['Santalaceae'],['Unknown'],['Jodina'],['Jodina rhombifolia'],4,3,7.167430877685547 1805,6171,970,Fatty acids,Octadecanoids,Other Octadecanoids,0.41685772,ISDB,KICRKYKTMPUVKC-OZSKJFCKSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-7-8-11-14-17(19)15-12-9-10-13-16-18(20)21/h2,7-8,17,19H,1,3-6,9-10,12-13,15-16H2,(H,20,21)/b8-7+/t17-/m0/s1",C=CCCCC/C=C/C#C[C@H](O)CCCCCCC(=O)O,C18H28O3,,292.203844756,KICRKYKTMPUVKC,Fatty acids,Octadecanoids,Other Octadecanoids,Jodina rhombifolia,124280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Santalales'],['Santalaceae'],['Unknown'],['Jodina'],['Jodina rhombifolia'],4,3,7.167430877685547 1806,6168,-1,,,,0.27499533,ISDB,BOOUTSYULZVFNI-JSOSOPNTSA-N,"InChI=1S/C20H28O6/c1-6-11(2)16(21)25-15-7-8-18(4)10-20(24)13(12(3)17(22)26-20)9-14(18)19(15,5)23/h6,14-15,23-24H,7-10H2,1-5H3/b11-6-/t14-,15+,18-,19+,20+/m1/s1",C/C=C(/C)C(=O)O[C@H]1CC[C@]2(C)C[C@]3(O)OC(=O)C(C)=C3C[C@H]2[C@]1(C)O,C20H28O6,,364.188588616,BOOUTSYULZVFNI,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Pluchea sagittalis,446137.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pluchea'],['Pluchea sagittalis'],4,0,5.099981307983398 1807,6167,147,Terpenoids,Monoterpenoids,Aristolane sesquiterpenoids,0.0,MS1_match,ZJIVEFDADFTLMI-ULWTYWRYSA-N,"InChI=1S/C15H24O2/c1-8-5-9(16)6-10-12(17)7-11-13(14(11,2)3)15(8,10)4/h6,8-9,11-13,16-17H,5,7H2,1-4H3/t8-,9-,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2[C@@H](O)C[C@@H]3[C@@H](C3(C)C)[C@]21C,C15H24O2,pos_1_1proton1methanol,236.177630008,ZJIVEFDADFTLMI,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 1808,6162,-1,,,,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton1isopropanol,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],9,0,9.0 1809,6160,90,Amino acids and Peptides,Small peptides,Aminoacids,0.3779706,ISDB,MIEILDYWGANZNH-BYULHYEWSA-N,"InChI=1S/C10H13NO5/c11-7(8(13)14)5-10(9(15)16)3-1-6(12)2-4-10/h1-4,6-7,12H,5,11H2,(H,13,14)(H,15,16)/t6-,7-,10-/m0/s1",N[C@@H](C[C@]1(C(=O)O)C=C[C@H](O)C=C1)C(=O)O,C10H13NO5,,227.079372516,MIEILDYWGANZNH,Amino acids and Peptides,Small peptides,Aminoacids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.011882424354553 1810,6157,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.7424901,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,1,7.469960451126099 1811,6156,1000,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,HVCNSAJVIFXBHU-UHFFFAOYSA-N,"InChI=1S/C5H8O4/c6-3-4(7)1-2-5(8)9/h6H,1-3H2,(H,8,9)",O=C(O)CCC(=O)CO,C5H8O4,pos_2MHNH3,132.042258736,HVCNSAJVIFXBHU,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 1812,6155,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.5683566,ISDB,DOFYAVLOCYRMIV-ULTRRKBWSA-N,"InChI=1S/C36H38N4O6/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)45-7)32(39-25)31-33-30(34(42)36(31,44)35(43)46-8)19(6)26(40-33)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,37,40,44H,1,10-12H2,2-8H3/t18-,22-,36-/m0/s1",C=Cc1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C)=C6CC)c(C)c5C(=O)[C@]4(O)C(=O)OC)[C@@H](CCC(=O)OC)[C@@H]3C,C36H38N4O6,,622.2791349360001,DOFYAVLOCYRMIV,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Clerodendrum calamitosum,6086132.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum calamitosum'],4,3,7.773426294326782 1813,6152,-1,,,,0.0,MS1_match,SGUOENJPMRQEMJ-PLNGHNRSSA-N,"InChI=1S/C19H34O9/c1-10(21)5-6-19(26)17(2,3)7-11(8-18(19,4)25)27-16-15(24)14(23)13(22)12(9-20)28-16/h5-6,10-16,20-26H,7-9H2,1-4H3/t10-,11-,12-,13-,14+,15-,16-,18+,19+/m1/s1",C[C@@H](O)C=C[C@]1(O)C(C)(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@]1(C)O,C19H34O9,pos_1_1proton1ammonium,406.220282668,SGUOENJPMRQEMJ,Terpenoids,Apocarotenoids,Megastigmanes,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1814,6152,-1,,,,0.0,MS1_match,FCSXIFYRVMQLAX-HPMNXYLDSA-N,"InChI=1S/C19H34O9/c1-10-6-12(7-18(2,3)19(10,26)5-4-11(22)8-20)27-17-16(25)15(24)14(23)13(9-21)28-17/h4-5,10-17,20-26H,6-9H2,1-3H3/b5-4+/t10-,11+,12+,13-,14+,15+,16-,17-,19-/m1/s1",C[C@@H]1C[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@@]1(O)/C=C/[C@H](O)CO,C19H34O9,pos_1_1proton1ammonium,406.220282668,FCSXIFYRVMQLAX,Terpenoids,Apocarotenoids,Megastigmanes,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 1815,6149,-1,,,,0.4419729,ISDB,DKGYTSKPMLWLEI-FIZOKRMRSA-N,"InChI=1S/C10H14O4/c1-5-2-3-6-7(9(11)12)4-14-10(13)8(5)6/h4-6,8,10,13H,2-3H2,1H3,(H,11,12)/t5-,6+,8+,10+/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O)[C@@H]21,C10H14O4,,198.089208928,DKGYTSKPMLWLEI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,8.767891645431519 1816,6139,-1,,,,0.2018555,ISDB,FKCWQMCLWHDMHQ-YOOCBKBXSA-N,"InChI=1S/C15H24N2O4/c18-10-1-2-16-6-8-3-9(11(16)4-10)7-17-12(8)5-13(19)14(20)15(17)21/h8-14,18-20H,1-7H2/t8-,9-,10-,11-,12+,13+,14-/m0/s1",O=C1[C@@H](O)[C@H](O)C[C@@H]2[C@H]3C[C@@H](CN12)[C@@H]1C[C@@H](O)CCN1C3,C15H24N2O4,,296.173607248,FKCWQMCLWHDMHQ,Alkaloids,Lysine alkaloids,Quinolizidine alkaloids,Calpurnia aurea,434094.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Podalyrieae'],['Calpurnia'],['Calpurnia aurea'],4,0,4.807421982288361 1817,6136,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.41984963,ISDB,JJLBUHCPBLNUIT-WROTWQSTSA-N,"InChI=1S/C32H40O17/c1-14-25(40)26(41)27(42)31(45-14)49-29-28(48-24(39)9-5-16-4-7-18(35)20(37)10-16)22(12-33)47-32(30(29)46-15(2)34)44-13-23(43-3)17-6-8-19(36)21(38)11-17/h4-11,14,22-23,25-33,35-38,40-42H,12-13H2,1-3H3/b9-5+/t14-,22+,23+,25-,26+,27+,28+,29-,30+,31-,32+/m0/s1",CO[C@H](CO[C@@H]1O[C@H](CO)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H]1OC(C)=O)c1ccc(O)c(O)c1,C32H40O17,,696.22654982,JJLBUHCPBLNUIT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cistanche phelypaea,675210.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Orobancheae'],['Cistanche'],['Cistanche phelypaea'],4,3,7.179398536682129 1818,6136,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.41984963,ISDB,JJLBUHCPBLNUIT-WROTWQSTSA-N,"InChI=1S/C32H40O17/c1-14-25(40)26(41)27(42)31(45-14)49-29-28(48-24(39)9-5-16-4-7-18(35)20(37)10-16)22(12-33)47-32(30(29)46-15(2)34)44-13-23(43-3)17-6-8-19(36)21(38)11-17/h4-11,14,22-23,25-33,35-38,40-42H,12-13H2,1-3H3/b9-5+/t14-,22+,23+,25-,26+,27+,28+,29-,30+,31-,32+/m0/s1",CO[C@H](CO[C@@H]1O[C@H](CO)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H]1OC(C)=O)c1ccc(O)c(O)c1,C32H40O17,,696.22654982,JJLBUHCPBLNUIT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cistanche tubulosa,368050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Orobancheae'],['Cistanche'],['Cistanche tubulosa'],4,3,7.179398536682129 1819,6135,-1,,,,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1potassium,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 1820,6135,-1,,,,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1potassium,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 1821,6133,-1,,,,0.5595636,ISDB,GQPHVVDGJWHSMR-MRVPVSSYSA-N,"InChI=1S/C12H15NO4/c1-7-8(2)17-12(16)11(7)13-9(5-14)3-4-10(13)6-15/h3-4,8,14-15H,5-6H2,1-2H3/t8-/m1/s1",CC1=C(n2c(CO)ccc2CO)C(=O)O[C@@H]1C,C12H15NO4,,237.10010796,GQPHVVDGJWHSMR,Polyketides,,,Quararibea funebris,5762173.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Quararibea'],['Quararibea funebris'],4,0,6.2382543087005615 1822,6132,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CRZQGDNQQAALAY-UHFFFAOYSA-N,"InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3",COC(=O)Cc1ccccc1,C9H10O2,pos_1_1proton,150.06807956,CRZQGDNQQAALAY,Shikimates and Phenylpropanoids,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 1823,6130,591,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.48075652,ISDB,GVSGSHGXUXLQNS-UHFFFAOYSA-N,"InChI=1S/C7H5BrO3/c8-5-1-4(3-9)2-6(10)7(5)11/h1-3,10-11H",O=Cc1cc(O)c(O)c(Br)c1,C7H5BrO3,,215.94220612,GVSGSHGXUXLQNS,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Rhodomela confervoides,855466.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Rhodomela'],['Rhodomela confervoides'],2,3,5.423026084899902 1824,6130,591,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.48075652,ISDB,GVSGSHGXUXLQNS-UHFFFAOYSA-N,"InChI=1S/C7H5BrO3/c8-5-1-4(3-9)2-6(10)7(5)11/h1-3,10-11H",O=Cc1cc(O)c(O)c(Br)c1,C7H5BrO3,,215.94220612,GVSGSHGXUXLQNS,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Polysiphonia lanosa,359042.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Vertebrata'],['Vertebrata lanosa'],2,3,5.423026084899902 1825,6130,591,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.48075652,ISDB,GVSGSHGXUXLQNS-UHFFFAOYSA-N,"InChI=1S/C7H5BrO3/c8-5-1-4(3-9)2-6(10)7(5)11/h1-3,10-11H",O=Cc1cc(O)c(O)c(Br)c1,C7H5BrO3,,215.94220612,GVSGSHGXUXLQNS,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Polysiphonia stricta,670250.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Polysiphonia'],['Polysiphonia stricta'],2,3,5.423026084899902 1826,6130,591,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.48075652,ISDB,GVSGSHGXUXLQNS-UHFFFAOYSA-N,"InChI=1S/C7H5BrO3/c8-5-1-4(3-9)2-6(10)7(5)11/h1-3,10-11H",O=Cc1cc(O)c(O)c(Br)c1,C7H5BrO3,,215.94220612,GVSGSHGXUXLQNS,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Polysiphonia urceolata,795169.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Polysiphonia'],['Polysiphonia urceolata'],2,3,5.423026084899902 1827,6130,591,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.48075652,ISDB,GVSGSHGXUXLQNS-UHFFFAOYSA-N,"InChI=1S/C7H5BrO3/c8-5-1-4(3-9)2-6(10)7(5)11/h1-3,10-11H",O=Cc1cc(O)c(O)c(Br)c1,C7H5BrO3,,215.94220612,GVSGSHGXUXLQNS,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Polysiphonia morrowii,723100.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Polysiphonia'],['Polysiphonia morrowii'],2,3,5.423026084899902 1828,6125,107,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,0.0,MS1_match,QLASPINFLLNESN-UVBAXCRRSA-N,"InChI=1S/C15H22O4/c1-8-5-9(16)6-10-11(17)7-12-13(15(8,10)4)14(2,3)19-18-12/h6,8-9,12-13,16H,5,7H2,1-4H3/t8-,9-,12-,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C[C@H]3OOC(C)(C)[C@H]3[C@]21C,C15H22O4,pos_1_1proton1methanol,266.151809184,QLASPINFLLNESN,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 1829,6125,107,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,0.0,MS1_match,NFAIEEHBPOJNKN-IPRJDCTKSA-N,"InChI=1S/C15H22O4/c1-7-5-8(16)6-9-10(17)11-12(19-11)13(14(2,3)18)15(7,9)4/h6-8,11-13,16,18H,5H2,1-4H3/t7-,8-,11-,12-,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)[C@H]3O[C@H]3[C@@H](C(C)(C)O)[C@]21C,C15H22O4,pos_1_1proton1methanol,266.151809184,NFAIEEHBPOJNKN,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 1830,6121,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.27866125,ISDB,QTUISSYYAYQHML-ZQAWKMMESA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22-,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia squarrosa,912596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia squarrosa'],4,2,6.114645004272461 1831,6121,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.27866125,ISDB,QTUISSYYAYQHML-UFONIEFXSA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22+,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia hirsutula,278958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia hirsutula'],4,2,6.114645004272461 1832,6121,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.27866125,ISDB,QTUISSYYAYQHML-ZQAWKMMESA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22-,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia camporum,974633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia camporum'],4,2,6.114645004272461 1833,6121,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.27866125,ISDB,QTUISSYYAYQHML-UFONIEFXSA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22+,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia stricta,981039.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia stricta'],4,2,6.114645004272461 1834,6120,812,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.43486282,ISDB,NVACRDDCQWUEKZ-PBCNUSJZSA-N,"InChI=1S/C36H36O16/c1-16-26(41)28(43)30(45)35(48-16)47-15-23-33(51-24(40)12-7-17-5-3-2-4-6-17)29(44)31(46)36(50-23)52-34-27(42)25-21(39)13-20(38)14-22(25)49-32(34)18-8-10-19(37)11-9-18/h2-14,16,23,26,28-31,33,35-39,41,43-46H,15H2,1H3/b12-7+/t16-,23+,26-,28+,29+,30+,31+,33-,35+,36-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2OC(=O)/C=C/c2ccccc2)[C@H](O)[C@H](O)[C@H]1O,C36H36O16,,724.200335072,NVACRDDCQWUEKZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Sinoadina racemosa,1089075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Sinoadina'],['Sinoadina racemosa'],4,3,7.239451289176941 1835,6119,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.64311945,ISDB,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus papposus,450630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus papposus'],6,3,10.0724778175354 1836,6119,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.64311945,ISDB,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,3,10.0724778175354 1837,6119,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.64311945,ISDB,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,3,10.0724778175354 1838,6119,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.64311945,ISDB,DLVLXOYLQKCAME-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O,C22H22O11,,462.116211524,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria leucantha,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,3,10.0724778175354 1839,6119,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.64311945,ISDB,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus plumosus,5746454.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus plumosus'],6,3,10.0724778175354 1840,6119,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.64311945,ISDB,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria uralensis,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,3,10.0724778175354 1841,6116,-1,,,,0.0,MS1_match,DZCMZVBXQQILBE-HROOGFMSSA-N,"InChI=1S/C42H47NO11/c1-8-24(2)36(45)51-32-31-34(49-26(4)44)42(54-40(31,5)6)25(3)22-30(50-37(46)27-16-11-9-12-17-27)33(52-39(48)29-20-15-21-43-23-29)41(42,7)35(32)53-38(47)28-18-13-10-14-19-28/h9-21,23-25,30-35H,8,22H2,1-7H3/t24?,25-,30+,31-,32-,33+,34-,35-,41+,42-/m1/s1",CCC(C)C(=O)O[C@@H]1[C@@H]2[C@@H](OC(C)=O)[C@]3(OC2(C)C)[C@H](C)C[C@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2cccnc2)[C@@]3(C)[C@@H]1OC(=O)c1ccccc1,C42H47NO11,pos_2_2proton3acetonitrile,741.314911324,DZCMZVBXQQILBE,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 1842,6113,-1,,,,0.22404444,ISDB,,,,,,,OZVSZAQHQAHZNC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8961777687072754 1843,6112,-1,,,,0.0,MS1_match,IKIIZLYTISPENI-ZFORQUDYSA-N,"InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2cc3oc(-c4ccccc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O11,pos_1_1proton,446.084911396,IKIIZLYTISPENI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum baicalense,1045100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum baicalense'],6,0,6.0 1844,6108,1264,Terpenoids,Macrolides,Macrolide lactones,0.4259067,ISDB,,,,,,,HHIATQMGSRWXBW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.7036267518997192 1845,6106,-1,,,,0.22577265,ISDB,,,,,,,SPUGTKTYKGAGRY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9030905961990356 1846,6103,-1,,,,0.0,MS1_match,TXICZRYGAMLPKS-AJKXIXENSA-N,"InChI=1S/C36H42O20/c1-12-23(41)26(44)27(45)35(49-12)53-18-9-19(40)22-20(10-18)54-30(16-5-7-17(39)8-6-16)33(25(22)43)56-36-29(47)32(24(42)13(2)50-36)55-34-28(46)31(52-15(4)38)21(11-48-34)51-14(3)37/h5-10,12-13,21,23-24,26-29,31-32,34-36,39-42,44-47H,11H2,1-4H3/t12-,13+,21-,23-,24+,26+,27+,28-,29-,31+,32-,34+,35-,36+/m0/s1",CC(=O)O[C@H]1[C@H](O)[C@@H](O[C@@H]2[C@H](O)[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](C)[C@H]2O)OC[C@@H]1OC(C)=O,C36H42O20,pos_2_1proton1sodium,794.226943744,TXICZRYGAMLPKS,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 1847,6100,-1,,,,0.26148275,ISDB,ICYRCNICGBJLGM-HJGDQZAQSA-N,"InChI=1S/C14H25N3O7/c1-6(2)4-8(15)12(21)17-11(7(3)18)13(22)16-9(14(23)24)5-10(19)20/h6-9,11,18H,4-5,15H2,1-3H3,(H,16,22)(H,17,21)(H,19,20)(H,23,24)/t7-,8+,9+,11+/m1/s1",CC(C)C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,C14H25N3O7,,347.16925014,ICYRCNICGBJLGM,Amino acids and Peptides,Small peptides,Tripeptides,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,0,2.0459309816360474 1848,6099,-1,,,,0.0,MS1_match,KVRQAVLXNPXEES-JRQMZCAUSA-N,"InChI=1S/C22H25NO7/c1-23(24)7-6-11-16-14(23)8-13-12(9-15(25-2)20(28-5)19(13)27-4)17(16)21-22(18(11)26-3)30-10-29-21/h9,14H,6-8,10H2,1-5H3/t14-,23?/m0/s1",COc1cc2c(c(OC)c1OC)C[C@H]1c3c(c(OC)c4c(c3-2)OCO4)CC[N+]1(C)[O-],C22H25NO7,pos_1_1proton1ethylamine,415.16310214,KVRQAVLXNPXEES,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,0,6.0 1849,6096,-1,,,,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2sodium,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,0,6.0 1850,6096,-1,,,,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2sodium,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,0,6.0 1851,6096,-1,,,,0.0,MS1_match,SIEZSHWOPJNWFA-UHFFFAOYSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)(O)C13OC(C)(C)C(C(OC(C)=O)C2OC(=O)c1ccccc1)C3OC(C)=O,C32H40O14,pos_2_2sodium,648.24180596,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,0,6.0 1852,6096,-1,,,,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2sodium,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,0,6.0 1853,6096,-1,,,,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2sodium,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,0,6.0 1854,6096,-1,,,,0.0,MS1_match,SIEZSHWOPJNWFA-UHFFFAOYSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)(O)C13OC(C)(C)C(C(OC(C)=O)C2OC(=O)c1ccccc1)C3OC(C)=O,C32H40O14,pos_2_2sodium,648.24180596,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,0,6.0 1855,6092,700,Amino acids and Peptides,Small peptides,Dipeptides,0.40460718,ISDB,MYFMARDICOWMQP-YUMQZZPRSA-N,"InChI=1S/C11H20N2O5/c1-6(2)5-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h6-8H,3-5,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)/t7-,8-/m0/s1",CC(C)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,C11H20N2O5,,260.13722174000003,MYFMARDICOWMQP,Amino acids and Peptides,Small peptides,Dipeptides,Vigna radiata,806245.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Vigna'],['Vigna radiata'],4,3,7.118428707122803 1856,6092,700,Amino acids and Peptides,Small peptides,Dipeptides,0.40460718,ISDB,MYFMARDICOWMQP-YUMQZZPRSA-N,"InChI=1S/C11H20N2O5/c1-6(2)5-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h6-8H,3-5,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)/t7-,8-/m0/s1",CC(C)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O,C11H20N2O5,,260.13722174000003,MYFMARDICOWMQP,Amino acids and Peptides,Small peptides,Dipeptides,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,3,7.118428707122803 1857,6090,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.49443159,ISDB,SMUVABOERCFKRW-UHFFFAOYSA-N,"InChI=1S/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H3",Cc1ccc(C)c(C=O)c1,C9H10O,,134.07316494,SMUVABOERCFKRW,Terpenoids,,,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,1,6.477726340293884 1858,6089,883,,,,0.25885817,ISDB,,,,,,,AHZCIODFJPNPKS,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0354326963424683 1859,6088,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.74309915,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,1,7.472396612167358 1860,6085,69,Terpenoids,Sesquiterpenoids,Furans,0.58029175,ISDB,CTLVRIOTFRWXKP-BGTYHANMSA-N,"InChI=1S/C18H28O/c1-13-7-6-8-16-17(13,4)11-9-14(2)18(16,5)12-10-15(3)19/h6-7,14,16H,1,8-12H2,2-5H3/t14-,16-,17+,18+/m1/s1",C=C1C=CC[C@H]2[C@@](C)(CCC(C)=O)[C@H](C)CC[C@@]12C,C18H28O,,260.214015516,CTLVRIOTFRWXKP,Terpenoids,Sesquiterpenoids,,Parentucellia latifolia,981066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Rhinantheae'],['Parentucellia'],['Parentucellia latifolia'],4,2,7.3211669921875 1861,6082,-1,,,,0.0,MS1_match,BYWPUNIXQZJWRS-UHFFFAOYSA-N,"InChI=1S/C10H16O3/c1-5-6-3-8(11)10(2)7(6)4-12-9(5)13-10/h5-9,11H,3-4H2,1-2H3",CC1C2OCC3C1CC(O)C3(C)O2,C10H16O3,pos_1_1proton1methanol,184.109944372,BYWPUNIXQZJWRS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 1862,6082,-1,,,,0.0,MS1_match,BYWPUNIXQZJWRS-RSMBCMNPSA-N,"InChI=1S/C10H16O3/c1-5-6-3-8(11)10(2)7(6)4-12-9(5)13-10/h5-9,11H,3-4H2,1-2H3/t5-,6+,7+,8-,9-,10-/m0/s1",C[C@@H]1[C@H]2OC[C@@H]3[C@@H]1C[C@H](O)[C@@]3(C)O2,C10H16O3,pos_1_1proton1methanol,184.109944372,BYWPUNIXQZJWRS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 1863,6082,-1,,,,0.0,MS1_match,KCIYXMDQXNFJBA-BDNRQGISSA-N,"InChI=1S/C10H16O3/c1-6-7-3-4-10(2,12)8(7)5-13-9(6)11/h6-8,12H,3-5H2,1-2H3/t6-,7-,8+,10-/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1CC[C@@]2(C)O,C10H16O3,pos_1_1proton1methanol,184.109944372,KCIYXMDQXNFJBA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 1864,6077,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.54134244,ISDB,,,,,,,SIYNRPHDAIDUJN,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.165369749069214 1865,6076,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,XRIDGQVLGQMCMX-OLEFQQMKSA-N,"InChI=1S/C15H16O7/c1-20-12-6-9(2-4-10(12)16)3-5-14(18)21-8-13-11(17)7-15(19)22-13/h2-6,11,13,16-17H,7-8H2,1H3/b5-3+/t11-,13+/m0/s1",COc1cc(/C=C/C(=O)OC[C@H]2OC(=O)C[C@@H]2O)ccc1O,C15H16O7,pos_1_1proton,308.089602852,XRIDGQVLGQMCMX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,3,9.5 1866,6074,-1,,,,0.33418226,ISDB,,,,,,,RSGRICGNCQRUJG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3367290496826172 1867,6073,659,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8089823,ISDB,DKEIMQZQSBDMFK-KPKKTSSRSA-N,"InChI=1S/C26H28O17/c27-5-13-17(34)20(37)24(43-25-21(38)18(35)14(6-28)40-25)26(41-13)42-23-19(36)15-9(30)3-8(29)4-12(15)39-22(23)7-1-10(31)16(33)11(32)2-7/h1-4,13-14,17-18,20-21,24-35,37-38H,5-6H2/t13-,14-,17-,18+,20+,21-,24-,25+,26+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O17,,612.132649436,DKEIMQZQSBDMFK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Phyllolobium chinense,192321.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Astragalus'],['Astragalus complanatus'],4,3,8.735929250717163 1868,6072,-1,,,,0.0,MS1_match,OVCJHKSGVQTJDE-PKAOLPJBSA-N,"InChI=1S/C32H34O14/c1-17(33)42-16-31-23(44-27(36)19-6-9-40-14-19)11-21-24(34)32(31,46-29(21,2)3)30(4,38)12-22(43-26(35)18-5-8-39-13-18)25(31)45-28(37)20-7-10-41-15-20/h5-10,13-15,21-25,34,38H,11-12,16H2,1-4H3/t21-,22+,23+,24-,25+,30+,31-,32+/m1/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccoc3)C[C@@H]3[C@@H](O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(=O)c1ccoc1)[C@@H]2OC(=O)c1ccoc1,C32H34O14,pos_2_1proton1sodium,642.194855768,OVCJHKSGVQTJDE,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,0,7.0 1869,6071,1326,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,WEYUSPOGCLAOEC-NCKBJQSISA-N,"InChI=1S/C29H38O16/c1-12(30)19-22(41-15(4)33)25(44-18(7)36)28(11-40-14(3)32)24(43-17(6)35)21(37)20-23(42-16(5)34)29(28,27(19,9)38)45-26(20,8)10-39-13(2)31/h19-20,22-25,38H,10-11H2,1-9H3/t19-,20+,22-,23+,24+,25-,26-,27-,28+,29-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(O[C@@]3(C)COC(C)=O)[C@@](C)(O)[C@@H](C(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O,C29H38O16,pos_2_2proton2acetonitrile,642.215985136,WEYUSPOGCLAOEC,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia chiapensis,6092929.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia chiapensis'],6,3,7.5 1870,6069,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,QUJBQBQAIZQWIV-UZTPMTCISA-N,"InChI=1S/C37H50ClN3O10/c1-18-11-10-12-27(48-9)37(46)17-26(49-35(45)40-37)21(4)32-36(6,51-32)28(50-34(44)22(5)41(7)33(43)30-19(2)20(30)3)16-29(42)39-24-14-23(13-18)15-25(47-8)31(24)38/h10-12,14-15,19-22,26-28,30,32,46H,13,16-17H2,1-9H3,(H,39,42)(H,40,45)/b12-10+,18-11+/t19?,20?,21-,22+,26+,27-,28+,30?,32+,36+,37+/m1/s1",COc1cc2cc(c1Cl)NC(=O)C[C@H](OC(=O)[C@H](C)N(C)C(=O)C1C(C)C1C)[C@]1(C)O[C@H]1[C@H](C)[C@@H]1C[C@@](O)(NC(=O)O1)[C@H](OC)/C=C/C=C(\C)C2,C37H50ClN3O10,pos_1_1proton1ethylamine,731.3184724799999,QUJBQBQAIZQWIV,Polyketides,Macrolides,Ansa macrolides,Gymnosporia buchananii,6092721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia buchananii'],6,0,6.0 1871,6069,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,QUJBQBQAIZQWIV-UZTPMTCISA-N,"InChI=1S/C37H50ClN3O10/c1-18-11-10-12-27(48-9)37(46)17-26(49-35(45)40-37)21(4)32-36(6,51-32)28(50-34(44)22(5)41(7)33(43)30-19(2)20(30)3)16-29(42)39-24-14-23(13-18)15-25(47-8)31(24)38/h10-12,14-15,19-22,26-28,30,32,46H,13,16-17H2,1-9H3,(H,39,42)(H,40,45)/b12-10+,18-11+/t19?,20?,21-,22+,26+,27-,28+,30?,32+,36+,37+/m1/s1",COc1cc2cc(c1Cl)NC(=O)C[C@H](OC(=O)[C@H](C)N(C)C(=O)C1C(C)C1C)[C@]1(C)O[C@H]1[C@H](C)[C@@H]1C[C@@](O)(NC(=O)O1)[C@H](OC)/C=C/C=C(\C)C2,C37H50ClN3O10,pos_1_1proton1ethylamine,731.3184724799999,QUJBQBQAIZQWIV,Polyketides,Macrolides,Ansa macrolides,Putterlickia verrucosa,332593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Putterlickia'],['Putterlickia verrucosa'],6,0,6.0 1872,6067,-1,,,,0.0,MS1_match,IUSBVFZKQJGVEP-SNAWJCMRSA-N,"InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+",C/C=C/c1ccc(OC(C)=O)c(OC)c1,C12H14O3,pos_1_1proton,206.094294308,IUSBVFZKQJGVEP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1873,6066,-1,,,,0.27949965,ISDB,ASSZAURWVSBFSV-UHFFFAOYSA-N,"InChI=1S/C48H68N8O12/c1-12-26(5)41-45(62)54-40(37(58)13-2)47(64)55(8)36(21-30-23-49-34-19-18-32(67-11)22-33(30)34)48(65)68-28(7)39(53-43(60)38(25(3)4)50-24-57)44(61)52-35(20-29-14-16-31(66-10)17-15-29)42(59)51-27(6)46(63)56(41)9/h14-19,22-28,35-41,49,58H,12-13,20-21H2,1-11H3,(H,50,57)(H,51,59)(H,52,61)(H,53,60)(H,54,62)",CCC(C)C1C(=O)NC(C(O)CC)C(=O)N(C)C(Cc2c[nH]c3ccc(OC)cc23)C(=O)OC(C)C(NC(=O)C(NC=O)C(C)C)C(=O)NC(Cc2ccc(OC)cc2)C(=O)NC(C)C(=O)N1C,C48H68N8O12,,948.495669616,ASSZAURWVSBFSV,Amino acids and Peptides,Oligopeptides,Cyclic peptides,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,0,1.1179986000061035 1874,6065,-1,,,,0.0,MS1_match,CZKPUZKGTUPACP-GFCCVEGCSA-N,"InChI=1S/C18H20O7/c1-23-14-6-10(4-5-13(14)20)17(21)12(9-19)11-7-15(24-2)18(22)16(8-11)25-3/h4-8,12,19-20,22H,9H2,1-3H3/t12-/m1/s1",COc1cc(C(=O)[C@H](CO)c2cc(OC)c(O)c(OC)c2)ccc1O,C18H20O7,pos_1_1proton1acetonitrile,348.1209029799999,CZKPUZKGTUPACP,Shikimates and Phenylpropanoids,Lignans,Minor lignans,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,0,6.0 1875,6062,1048,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.5552001,ISDB,BAYNPTIBKPKGFB-WARGXTRISA-N,"InChI=1S/C42H46O24/c1-14-28(50)38(65-41-35(57)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)36(58)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)39(31(27)53)66-40-34(56)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,38,40-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24-,25-,28-,29-,30-,32+,33+,34-,35-,36-,38+,40+,41+,42+/m0/s1",C[C@@H]1O[C@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@H](O[C@H]2O[C@@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H]1O,C42H46O24,,934.237902352,BAYNPTIBKPKGFB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,9.720800399780273 1876,6062,1048,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.5552001,ISDB,BAYNPTIBKPKGFB-XYCWGEMUSA-N,"InChI=1S/C42H46O24/c1-14-28(50)38(65-41-35(57)33(55)30(52)25(64-41)13-59-26(49)7-3-15-2-5-18(44)20(46)8-15)36(58)42(60-14)61-17-10-22(48)27-23(11-17)62-37(16-4-6-19(45)21(47)9-16)39(31(27)53)66-40-34(56)32(54)29(51)24(12-43)63-40/h2-11,14,24-25,28-30,32-36,38,40-48,50-52,54-58H,12-13H2,1H3/b7-3+/t14-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,38+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H46O24,,934.237902352,BAYNPTIBKPKGFB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,3,9.720800399780273 1877,6054,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.31788945,ISDB,GCXYZMBESPRGQQ-RQOJZXTJSA-N,"InChI=1S/C24H40O6/c1-15(25)28-14-19(29-16(2)26)24(7)13-17(27)20-22(5)11-8-10-21(3,4)18(22)9-12-23(20,6)30-24/h17-20,27H,8-14H2,1-7H3/t17-,18+,19+,20-,22+,23-,24+/m1/s1",CC(=O)OC[C@H](OC(C)=O)[C@]1(C)C[C@@H](O)[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@@]2(C)O1,C24H40O6,,424.282489,GCXYZMBESPRGQQ,Terpenoids,Diterpenoids,Labdane diterpenoids,Grindelia tarapacana,178346.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia tarapacana'],4,2,6.271557807922363 1878,6050,-1,,,,0.0,MS1_match,YFNGFDLAUMVQDZ-YSZGHJDFSA-N,"InChI=1S/C43H48N2O10/c1-45-14-12-28-31(21-38(49-4)43(53-8)42(28)52-7)33(45)16-26-10-9-25(40(50-5)41(26)51-6)15-27-18-36-37(55-23-54-36)19-29(27)32(22-46)39-30-20-35(48-3)34(47-2)17-24(30)11-13-44-39/h9-10,17-22,33,44H,11-16,23H2,1-8H3/b39-32+/t33-/m1/s1",COc1cc2c(cc1OC)/C(=C(/C=O)c1cc3c(cc1Cc1ccc(C[C@@H]4c5cc(OC)c(OC)c(OC)c5CCN4C)c(OC)c1OC)OCO3)NCC2,C43H48N2O10,pos_2_1proton1potassium,752.330895736,YFNGFDLAUMVQDZ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Isopyrum thalictroides,949657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Isopyrum'],['Isopyrum thalictroides'],6,0,6.0 1879,6050,-1,,,,0.0,MS1_match,JPDSPHUAHNLFAY-CONSDPRKSA-N,"InChI=1S/C43H48N2O10/c1-23(46)53-36-21-28-26(18-34(36)49-6)12-14-44(3)30(28)16-25-10-11-32(48-5)35(17-25)55-33-22-38(51-8)43(54-24(2)47)40-29(33)20-31-39-27(13-15-45(31)4)19-37(50-7)42(52-9)41(39)40/h10-11,17-19,21-22,30-31H,12-16,20H2,1-9H3/t30-,31-/m0/s1",COc1cc2c(cc1OC(C)=O)[C@H](Cc1ccc(OC)c(Oc3cc(OC)c(OC(C)=O)c4c3C[C@H]3c5c(cc(OC)c(OC)c5-4)CCN3C)c1)N(C)CC2,C43H48N2O10,pos_2_1proton1potassium,752.330895736,JPDSPHUAHNLFAY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum tuberiferum,338809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum tuberiferum'],6,0,6.0 1880,6049,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.42045614,ISDB,LJEHGUMLAXBRJI-GYPOYYOSSA-N,"InChI=1S/C30H26O14/c31-10-3-17(36)23-22(4-10)43-28(9-1-19(38)26(41)20(39)2-9)27(42)25(23)24-18(37)8-14(33)12-6-21(40)29(44-30(12)24)11-5-15(34)16(35)7-13(11)32/h1-5,7-8,21,25,27-29,31-42H,6H2/t21-,25-,27-,28-,29-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)cc1O)[C@H](O)C2,C30H26O14,,610.132255512,LJEHGUMLAXBRJI,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,Limonium gmelinii,387499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Plumbaginaceae'],['Unknown'],['Limonium'],['Limonium gmelinii'],4,3,7.181824564933777 1881,6048,-1,,,,0.0,MS1_match,NBCWSGSBMHILQP-GAGVYUBLSA-N,"InChI=1S/C17H26O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h6-7,12-15,17-22H,3-5,8H2,1-2H3/t12-,13-,14+,15-,17+/m1/s1",COc1cc(CCCO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H26O9,pos_1_1proton1ammonium,374.1576824119999,NBCWSGSBMHILQP,,,,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1882,6048,-1,,,,0.0,MS1_match,NBCWSGSBMHILQP-GAGVYUBLSA-N,"InChI=1S/C17H26O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h6-7,12-15,17-22H,3-5,8H2,1-2H3/t12-,13-,14+,15-,17+/m1/s1",COc1cc(CCCO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H26O9,pos_1_1proton1ammonium,374.1576824119999,NBCWSGSBMHILQP,,,,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 1883,6046,391,Alkaloids,Ornithine alkaloids,Polyamines,0.30171856,ISDB,,,,,,,REPZVFPZZXRMMQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2068742513656616 1884,6044,1529,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.23467718,ISDB,QSGAITMJUHFIII-CEZLRWQGSA-N,"InChI=1S/C17H24O7/c1-9(2)12-4-5-17(22)8-24-16(21)14(17)13(12)6-11(15(19)20)7-23-10(3)18/h6,9,12-14,22H,4-5,7-8H2,1-3H3,(H,19,20)/b11-6+/t12-,13-,14-,17-/m1/s1",CC(=O)OC/C(=C\[C@@H]1[C@@H](C(C)C)CC[C@@]2(O)COC(=O)[C@@H]12)C(=O)O,C17H24O7,,340.152203108,QSGAITMJUHFIII,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Aspergillus flavus,188996.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus flavus'],1,3,3.4387087225914 1885,6042,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.61411434,ISDB,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],9,3,12.956457376480103 1886,6036,-1,,,,0.0,MS1_match,HXXFEZGVIOLPLF-YMIKPDPTSA-N,"InChI=1S/C31H34O11/c1-18(32)39-17-30-21(40-22(33)13-12-19-9-6-5-7-10-19)14-15-29(4,37)31(30)25(35)23(28(2,3)42-31)24(34)26(30)41-27(36)20-11-8-16-38-20/h5-13,16,21,23,25-26,35,37H,14-15,17H2,1-4H3/b13-12-/t21-,23+,25+,26+,29-,30-,31+/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(=O)/C=C\c3ccccc3)CC[C@](C)(O)[C@@]13OC(C)(C)[C@H](C(=O)[C@H]2OC(=O)c1ccco1)[C@H]3O,C31H34O11,pos_1_1proton,582.210111908,HXXFEZGVIOLPLF,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 1887,6034,-1,,,,0.0,MS1_match,XQFHNOITSVLCHN-TWCWKPIJSA-N,"InChI=1S/C28H42O3/c1-16-13-23-25(3,15-21(16)30)9-11-27(5)22-8-7-18-17(2)24(31)20(29)14-19(18)26(22,4)10-12-28(23,27)6/h16,19-20,22-23,29H,7-15H2,1-6H3/t16-,19-,20+,22+,23-,25+,26+,27-,28+/m1/s1",CC1=C2CC[C@H]3[C@@](C)(CC[C@@]4(C)[C@@H]5C[C@@H](C)C(=O)C[C@]5(C)CC[C@]34C)[C@@H]2C[C@H](O)C1=O,C28H42O3,pos_1_1potassium,426.313395204,XQFHNOITSVLCHN,Terpenoids,Triterpenoids,Friedelane triterpenoids,Microtropis triflora,1045126.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis triflora'],6,0,6.0 1888,6029,-1,,,,0.0,MS1_match,USMYUFNGIMZGOD-VVYIQUKOSA-N,"InChI=1S/C32H56O14/c1-29(2)17-6-10-31(4)18(30(17,3)9-8-19(29)44-27-25(40)23(38)21(36)15(12-33)42-27)7-11-32(5,46-31)20(14-35)45-28-26(41)24(39)22(37)16(13-34)43-28/h15-28,33-41H,6-14H2,1-5H3/t15-,16-,17-,18+,19-,20+,21-,22-,23+,24+,25-,26-,27+,28+,30-,31+,32-/m1/s1",CC1(C)[C@H]2CC[C@]3(C)O[C@@](C)([C@H](CO)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@H]3[C@]2(C)CC[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H56O14,pos_1_sodium,664.367006472,USMYUFNGIMZGOD,Terpenoids,Diterpenoids,,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,0,6.0 1889,6029,-1,,,,0.0,MS1_match,UGXGNDFGUYJPTJ-SVVOPOECSA-N,"InChI=1S/C32H56O14/c1-29(2)17-6-10-31(4)18(30(17,3)9-8-20(29)45-28-26(41)24(39)22(37)16(13-34)44-28)7-11-32(5,46-31)19(35)14-42-27-25(40)23(38)21(36)15(12-33)43-27/h15-28,33-41H,6-14H2,1-5H3/t15-,16-,17-,18+,19+,20-,21-,22-,23+,24+,25-,26-,27-,28+,30-,31+,32-/m1/s1",CC1(C)[C@H]2CC[C@]3(C)O[C@@](C)([C@@H](O)CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@H]3[C@]2(C)CC[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H56O14,pos_1_sodium,664.367006472,UGXGNDFGUYJPTJ,Terpenoids,Diterpenoids,,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,0,6.0 1890,6028,-1,,,,0.21995993,ISDB,,,,,,,WEHKZGYZEFGSOC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8798397183418274 1891,6027,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.5388957,ISDB,BVEVSYQMQABMQM-UHFFFAOYSA-N,"InChI=1S/C21H36O11/c1-19(2)9-4-12(20(19,3)5-10(9)23)32-17-15(26)14(25)13(24)11(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-18,22-28H,4-8H2,1-3H3",CC1(C)C2CC(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C1(C)CC2O,C21H36O11,,464.225761972,BVEVSYQMQABMQM,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,9.155582904815674 1892,6025,-1,,,,0.20576283,ISDB,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.823051333427429 1893,6025,-1,,,,0.20576283,ISDB,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.823051333427429 1894,6024,957,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.60322213,ISDB,SWYRVCGNMNAFEK-WENAFLHNSA-N,"InChI=1S/C19H30O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-7,11,13-17,20,22-25H,8-9H2,1-4H3/b6-5+/t11-,13-,14-,15+,16-,17+,19-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H30O8,,386.19406792,SWYRVCGNMNAFEK,Terpenoids,Apocarotenoids,Megastigmanes,Epimedium grandiflorum,655264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium grandiflorum'],5,1,7.912888526916504 1895,6022,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2proton,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,2,7.0 1896,6022,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2proton,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,2,7.0 1897,6022,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,SIEZSHWOPJNWFA-UHFFFAOYSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)(O)C13OC(C)(C)C(C(OC(C)=O)C2OC(=O)c1ccccc1)C3OC(C)=O,C32H40O14,pos_2_2proton,648.24180596,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,2,7.0 1898,6022,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2proton,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,2,7.0 1899,6022,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,SIEZSHWOPJNWFA-SQSDACCSSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3/t22-,23+,24-,25-,26+,27-,30-,31-,32-/m0/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C32H40O14,pos_2_2proton,648.2418059599999,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,2,7.0 1900,6022,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,SIEZSHWOPJNWFA-UHFFFAOYSA-N,"InChI=1S/C32H40O14/c1-16(33)40-15-31-25(43-19(4)36)22(41-17(2)34)14-30(8,39)32(31)26(44-20(5)37)23(29(6,7)46-32)24(42-18(3)35)27(31)45-28(38)21-12-10-9-11-13-21/h9-13,22-27,39H,14-15H2,1-8H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)(O)C13OC(C)(C)C(C(OC(C)=O)C2OC(=O)c1ccccc1)C3OC(C)=O,C32H40O14,pos_2_2proton,648.24180596,SIEZSHWOPJNWFA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,2,7.0 1901,6020,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.33244735,ISDB,AUTADROYLXMWLA-PQWVYKBBSA-N,"InChI=1S/C41H44O22/c1-16-28(48)31(51)33(53)38(58-16)56-13-25-29(49)32(52)36(62-26(47)9-3-17-2-8-21(44)22(45)10-17)39(61-25)59-20-11-23(46)27-24(12-20)60-34(18-4-6-19(43)7-5-18)35(30(27)50)63-40-37(54)41(55,14-42)15-57-40/h2-12,16,25,28-29,31-33,36-40,42-46,48-49,51-55H,13-15H2,1H3/b9-3+/t16-,25-,28-,29+,31+,32+,33+,36-,37+,38+,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](OC[C@@H]2O[C@@H](Oc3cc(O)c4c(=O)c(O[C@H]5OC[C@@](O)(CO)[C@@H]5O)c(-c5ccc(O)cc5)oc4c3)[C@@H](OC(=O)/C=C/c3ccc(O)c(O)c3)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H44O22,,888.232423048,AUTADROYLXMWLA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Silphium perfoliatum,464977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Silphium'],['Silphium perfoliatum'],4,3,6.829789400100708 1902,6019,642,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.21938713,ISDB,IKMDFBPHZNJCSN-UHFFFAOYSA-N,"InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H",O=c1c(O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O8,,318.03756728,IKMDFBPHZNJCSN,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,8.377548515796661 1903,6015,1560,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,0.0,MS1_match,AYHOUUNTAVCXBN-CYBMUJFWSA-N,"InChI=1S/C15H12O6/c16-8-1-7(2-9(17)3-8)13-6-12(20)15-11(19)4-10(18)5-14(15)21-13/h1-5,13,16-19H,6H2/t13-/m1/s1",O=C1C[C@H](c2cc(O)cc(O)c2)Oc2cc(O)cc(O)c21,C15H12O6,pos_1_1proton,288.063388104,AYHOUUNTAVCXBN,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,2,7.0 1904,6011,407,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.5673077,ISDB,BHZKXYVGAILXRA-DUXRVPMWSA-N,"InChI=1S/C41H44O23/c1-14-35(62-26(49)7-3-15-2-5-18(43)20(45)8-15)32(54)34(56)39(58-14)64-38-28(50)23(48)13-57-41(38)63-37-30(52)27-22(47)10-17(59-40-33(55)31(53)29(51)25(12-42)61-40)11-24(27)60-36(37)16-4-6-19(44)21(46)9-16/h2-11,14,23,25,28-29,31-35,38-48,50-51,53-56H,12-13H2,1H3/b7-3+/t14-,23-,25+,28-,29+,31-,32-,33+,34+,35-,38+,39-,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1,C41H44O23,,904.227337668,BHZKXYVGAILXRA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Plocama calabrica,877661.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Putorieae'],['Plocama'],['Plocama calabrica'],4,3,7.769230842590332 1905,6000,-1,,,,0.29569313,ISDB,WVHDCAPOGJJVCD-UHFFFAOYSA-N,"InChI=1S/C42H46O21/c1-16-28(47)31(50)34(53)40(57-16)56-15-25-38(62-26(46)12-5-18-3-8-20(43)9-4-18)33(52)36(55)42(61-25)63-39-30(49)27-23(45)13-22(59-41-35(54)32(51)29(48)17(2)58-41)14-24(27)60-37(39)19-6-10-21(44)11-7-19/h3-14,16-17,25,28-29,31-36,38,40-45,47-48,50-55H,15H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)cc4)oc4cc(OC5OC(C)C(O)C(O)C5O)cc(O)c4c3=O)C(O)C(O)C2OC(=O)C=Cc2ccc(O)cc2)C(O)C(O)C1O,C42H46O21,,886.253158492,WVHDCAPOGJJVCD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Eustoma grandiflorum,633066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Chironieae'],['Eustoma'],['Eustoma exaltatum'],4,0,5.182772517204285 1906,5998,-1,,,,0.3397434,ISDB,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,7.3589736223220825 1907,5998,-1,,,,0.3397434,ISDB,WRXVPTMENPZUIZ-UHFFFAOYSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C33H40O19,,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,7.3589736223220825 1908,5998,-1,,,,0.3397434,ISDB,WRXVPTMENPZUIZ-MOVIZTNPSA-N,"InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O19,,740.21637906,WRXVPTMENPZUIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,7.3589736223220825 1909,5997,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.6419523,ISDB,ASYWVBBBOMJYAC-DYEAUMGKSA-N,"InChI=1S/C11H12O5/c1-5-3-8-9(7(13)4-15-8)10(14)11(5)16-6(2)12/h4-5,11,13H,3H2,1-2H3/t5-,11-/m0/s1",CC(=O)O[C@@H]1C(=O)c2c(O)coc2C[C@@H]1C,C11H12O5,,224.068473484,ASYWVBBBOMJYAC,Terpenoids,,,Clinopodium ashei,248835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Clinopodium'],['Clinopodium ashei'],4,1,7.067809104919434 1910,5996,-1,,,,0.4500774,ISDB,WVHAUDNUGBNUDZ-GOVZDWNOSA-N,"InChI=1S/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9+,10-,12+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O,C12H14O7,,270.073952788,WVHAUDNUGBNUDZ,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,5.800309658050537 1911,5994,1000,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.3336145,ISDB,,,,,,,PGCOHQZPXWBFSZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3344579935073853 1912,5990,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.46376303,ISDB,USQXPEWRYWRRJD-UHFFFAOYSA-N,"InChI=1S/C15H12O7/c16-7-3-8(17)14-9(18)5-12(22-13(14)4-7)6-1-10(19)15(21)11(20)2-6/h1-4,12,16-17,19-21H,5H2",O=C1CC(c2cc(O)c(O)c(O)c2)Oc2cc(O)cc(O)c21,C15H12O7,,304.058302724,USQXPEWRYWRRJD,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Xerochrysum bracteatum,210846.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Xerochrysum'],['Xerochrysum bracteatum'],4,2,6.85505211353302 1913,5987,-1,,,,0.3203083,ISDB,CBSLALAKOKYDBZ-KWXOLURISA-N,"InChI=1S/C39H50O25/c1-10-21(45)26(50)29(53)36(57-10)56-9-19-24(48)28(52)35(64-38-31(55)33(22(46)11(2)58-38)62-37-30(54)27(51)23(47)18(8-40)60-37)39(61-19)63-34-25(49)20-16(44)6-13(41)7-17(20)59-32(34)12-3-4-14(42)15(43)5-12/h3-7,10-11,18-19,21-24,26-31,33,35-48,50-55H,8-9H2,1-2H3/t10-,11+,18-,19-,21-,22+,23-,24+,26+,27+,28+,29+,30-,31-,33-,35-,36+,37+,38+,39+/m0/s1",C[C@@H]1O[C@@H](OC[C@@H]2O[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@@H](O[C@H]3O[C@H](C)[C@@H](O)[C@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C39H50O25,,918.2641171000004,CBSLALAKOKYDBZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,7.281233191490173 1914,5986,-1,,,,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_2MNa,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 1915,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,5.23175323009491 1916,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,0,5.23175323009491 1917,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Rorippa indica,341724.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Cardamineae'],['Rorippa'],['Rorippa indica'],4,0,5.23175323009491 1918,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,0,5.23175323009491 1919,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,0,5.23175323009491 1920,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Raphanus sativus,359073.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Raphanus'],['Raphanus sativus'],4,0,5.23175323009491 1921,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Raphanus raphanistrum,376999.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Raphanus'],['Raphanus raphanistrum'],4,0,5.23175323009491 1922,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Bunias orientalis,19452.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Buniadeae'],['Bunias'],['Bunias orientalis'],4,0,5.23175323009491 1923,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Rheum rhaponticum,287577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Polygonaceae'],['Rumiceae'],['Rheum'],['Rheum rhaponticum'],4,0,5.23175323009491 1924,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Rheum rhabarbarum,693832.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Polygonaceae'],['Rumiceae'],['Rheum'],['Rheum rhabarbarum'],4,0,5.23175323009491 1925,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],4,0,5.23175323009491 1926,5979,-1,,,,0.3079383,ISDB,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Swertia japonica,774409.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Swertia'],['Swertia japonica'],4,0,5.23175323009491 1927,5977,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.35956147,ISDB,LGADBFMTBLRZEN-CYMJGCRDSA-N,"InChI=1S/C41H64O11/c1-22-31(44)32(45)33(46)34(50-22)52-30-19-29(51-24(3)43)38(6,21-49-23(2)42)27-13-14-40(8)28(41(27,30)9)12-11-25-26-20-37(5,35(47)48-10)16-15-36(26,4)17-18-39(25,40)7/h11,22,26-34,44-46H,12-21H2,1-10H3/t22-,26+,27-,28-,29-,30-,31-,32+,33+,34-,36+,37+,38-,39+,40+,41-/m0/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)[C@@H](O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C[C@H](OC(C)=O)[C@@](C)(COC(C)=O)[C@@H]5CC[C@]43C)[C@H]2C1,C41H64O11,,732.4448628680001,LGADBFMTBLRZEN,Terpenoids,Triterpenoids,Oleanane triterpenoids,Combretum sundaicum,6119944.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Combretaceae'],['Unknown'],['Combretum'],['Combretum sundaicum'],4,3,6.938245892524719 1928,5975,-1,,,,0.0,MS1_match,WMEDLAURVXZWQZ-DGUWLTKGSA-N,"InChI=1S/C19H28O2/c1-12-4-3-8-18(2)15(12)7-9-19-10-13(5-6-16(18)19)14(11-19)17(20)21/h13-16H,1,3-11H2,2H3,(H,20,21)/t13-,14+,15-,16+,18-,19+/m1/s1",C=C1CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@H](C(=O)O)C3,C19H28O2,pos_1_minus1proton2potassium,288.208930136,WMEDLAURVXZWQZ,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Maytenus magellanica,433237.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus magellanica'],6,0,6.0 1929,5971,1305,Alkaloids,Pseudoalkaloids,Phenylalanine-derived alkaloids,0.0,MS1_match,QFNZWJWWABAZNV-WPRPVWTQSA-N,"InChI=1S/C10H13NO2/c1-8(11-7-12)10(13)9-5-3-2-4-6-9/h2-8,10,13H,1H3,(H,11,12)/t8-,10-/m0/s1",C[C@H](NC=O)[C@H](O)c1ccccc1,C10H13NO2,pos_1_1proton,179.094628656,QFNZWJWWABAZNV,Alkaloids,Pseudoalkaloids,Phenylalanine-derived alkaloids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 1930,5970,-1,,,,0.0,MS1_match,VYBREYKSZAROCT-UHFFFAOYSA-N,"InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5H,1-2,4,6-8H2,3H3",C=CC(=C)CCCC(=C)C,C10H16,pos_1_1proton,136.125200512,VYBREYKSZAROCT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 1931,5970,-1,,,,0.0,MS1_match,GRWFGVWFFZKLTI-UHFFFAOYSA-N,"InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3",CC1=CCC2CC1C2(C)C,C10H16,pos_1_1proton,136.125200512,GRWFGVWFFZKLTI,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 1932,5970,-1,,,,0.0,MS1_match,NDUIFQPPDDOKRN-UHFFFAOYSA-N,"InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8H,4-6H2,1-3H3",CC1=C2CC(CC1)C2(C)C,C10H16,pos_1_1proton,136.125200512,NDUIFQPPDDOKRN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 1933,5969,1560,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,0.0,MS1_match,KJXSIXMJHKAJOD-HUUCEWRRSA-N,"InChI=1S/C15H12O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,14-20,22H/t14-,15-/m1/s1",O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O)c(O)c2)[C@@H]1O,C15H12O8,pos_1_1proton,320.053217344,KJXSIXMJHKAJOD,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,3,7.5 1934,5969,1560,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,0.0,MS1_match,KJXSIXMJHKAJOD-LSDHHAIUSA-N,"InChI=1S/C15H12O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,14-20,22H/t14-,15+/m0/s1",O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O)c(O)c2)[C@H]1O,C15H12O8,pos_1_1proton,320.0532173439999,KJXSIXMJHKAJOD,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 1935,5969,1560,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,0.0,MS1_match,KJXSIXMJHKAJOD-HUUCEWRRSA-N,"InChI=1S/C15H12O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,14-20,22H/t14-,15-/m1/s1",O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O)c(O)c2)[C@@H]1O,C15H12O8,pos_1_1proton,320.053217344,KJXSIXMJHKAJOD,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,3,7.5 1936,5969,1560,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,0.0,MS1_match,KJXSIXMJHKAJOD-LSDHHAIUSA-N,"InChI=1S/C15H12O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,14-20,22H/t14-,15+/m0/s1",O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O)c(O)c2)[C@H]1O,C15H12O8,pos_1_1proton,320.0532173439999,KJXSIXMJHKAJOD,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 1937,5967,-1,,,,0.6393328,ISDB,,,,,,,LMCPFFPDMJWFKE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.557331085205078 1938,5966,695,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,0.0,MS1_match,BCEDRNOWFQRFAS-BHXAHMMPSA-N,"InChI=1S/C37H44O17/c1-9-22-14-15-25(43)52-31-28(48-17(2)38)32(51-20(5)41)36(53-21(6)42)30(50-19(4)40)27(44)26-29(49-18(3)39)37(36,35(31,8)46)54-34(26,7)16-47-33(45)24-13-11-10-12-23(22)24/h10-13,22,26,28-32,46H,9,14-16H2,1-8H3/t22-,26-,28+,29-,30-,31+,32+,34+,35+,36+,37+/m1/s1",CC[C@@H]1CCC(=O)O[C@H]2[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(OC(C)=O)[C@H](OC(C)=O)C(=O)[C@@H]4[C@@H](OC(C)=O)[C@]3(O[C@@]4(C)COC(=O)c3ccccc31)[C@@]2(C)O,C37H44O17,pos_2_2sodium,760.257849948,BCEDRNOWFQRFAS,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Orthosphenia mexicana,755524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Orthosphenia'],['Orthosphenia mexicana'],6,3,7.5 1939,5960,1581,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.50076634,ISDB,NFPUDFZBEBPMIG-UHFFFAOYSA-N,"InChI=1S/C42H46O22/c1-15-28(48)31(51)34(54)40(58-15)57-14-25-38(63-26(47)10-4-17-3-9-21(44)22(45)11-17)33(53)36(56)42(62-25)64-39-30(50)27-23(46)12-20(60-41-35(55)32(52)29(49)16(2)59-41)13-24(27)61-37(39)18-5-7-19(43)8-6-18/h3-13,15-16,25,28-29,31-36,38,40-46,48-49,51-56H,14H2,1-2H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)cc4)oc4cc(OC5OC(C)C(O)C(O)C5O)cc(O)c4c3=O)C(O)C(O)C2OC(=O)C=Cc2ccc(O)c(O)c2)C(O)C(O)C1O,C42H46O22,,902.248073112,NFPUDFZBEBPMIG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Eustoma grandiflorum,633066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Chironieae'],['Eustoma'],['Eustoma exaltatum'],4,3,7.503065347671509 1940,5958,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.2173787,ISDB,,,,,,,XNZFISULTQJHKI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8695148229598999 1941,5957,1318,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.84153134,ISDB,FOENAQXATBLGSL-LVNOGPFZSA-N,"InChI=1S/C25H26O15/c26-7-25(35)8-37-24(22(25)34)40-21-17(32)14(31)6-36-23(21)39-20-18(33)16-13(30)4-10(27)5-15(16)38-19(20)9-1-2-11(28)12(29)3-9/h1-5,14,17,21-24,26-32,34-35H,6-8H2/t14-,17-,21+,22-,23-,24-,25+/m0/s1",O=c1c(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C25H26O15,,566.127170132,FOENAQXATBLGSL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Securidaca diversifolia,414987.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Polygalaceae'],['Unknown'],['Securidaca'],['Securidaca diversifolia'],4,3,8.866125345230103 1942,5957,1318,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.84153134,ISDB,FOENAQXATBLGSL-LVNOGPFZSA-N,"InChI=1S/C25H26O15/c26-7-25(35)8-37-24(22(25)34)40-21-17(32)14(31)6-36-23(21)39-20-18(33)16-13(30)4-10(27)5-15(16)38-19(20)9-1-2-11(28)12(29)3-9/h1-5,14,17,21-24,26-32,34-35H,6-8H2/t14-,17-,21+,22-,23-,24-,25+/m0/s1",O=c1c(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@](O)(CO)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C25H26O15,,566.127170132,FOENAQXATBLGSL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Neolitsea konishii,5699237.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Neolitsea'],['Neolitsea konishii'],4,3,8.866125345230103 1943,5956,1305,Alkaloids,Pseudoalkaloids,Phenylalanine-derived alkaloids,0.0,MS1_match,JRHJSZMJYORLNR-RAMPUJJFSA-N,"InChI=1S/C34H37NO13/c1-18(36)44-26-24-25(46-28(38)19-7-8-23(37)35(6)15-19)27(47-30(40)21-11-14-43-17-21)33(5)22(45-29(39)20-10-13-42-16-20)9-12-32(4,41)34(26,33)48-31(24,2)3/h7-8,10-11,13-17,22,24-27,41H,9,12H2,1-6H3/t22-,24+,25-,26+,27-,32-,33-,34-/m0/s1",CC(=O)O[C@@H]1[C@H]2[C@H](OC(=O)c3ccc(=O)n(C)c3)[C@H](OC(=O)c3ccoc3)[C@]3(C)[C@@H](OC(=O)c4ccoc4)CC[C@](C)(O)[C@@]13OC2(C)C,C34H37NO13,pos_3_1proton2sodium,667.226490244,JRHJSZMJYORLNR,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Reissantia buchananii,380816.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Reissantia'],['Reissantia buchananii'],6,0,6.0 1944,5955,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.44415736,ISDB,SJYNIERRENYANO-PMYXOSJASA-N,"InChI=1S/C31H36O20/c32-6-17-20(38)22(40)24(42)28(50-17)49-15-3-10(1-2-12(15)34)25-23(41)21(39)18-13(35)4-11(5-16(18)48-25)47-29-26(19(37)14(36)7-45-29)51-30-27(43)31(44,8-33)9-46-30/h1-5,14,17,19-20,22,24,26-30,32-38,40-44H,6-9H2/t14-,17-,19+,20-,22+,24-,26-,27+,28-,29+,30+,31-/m1/s1",O=c1c(O)c(-c2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)cc(O)c12,C31H36O20,,728.179993552,SJYNIERRENYANO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Hyssopus officinalis,880695.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Hyssopus'],['Hyssopus officinalis'],4,3,7.276629447937012 1945,5953,297,Terpenoids,Diterpenoids,,0.0,MS1_match,USMYUFNGIMZGOD-VVYIQUKOSA-N,"InChI=1S/C32H56O14/c1-29(2)17-6-10-31(4)18(30(17,3)9-8-19(29)44-27-25(40)23(38)21(36)15(12-33)42-27)7-11-32(5,46-31)20(14-35)45-28-26(41)24(39)22(37)16(13-34)43-28/h15-28,33-41H,6-14H2,1-5H3/t15-,16-,17-,18+,19-,20+,21-,22-,23+,24+,25-,26-,27+,28+,30-,31+,32-/m1/s1",CC1(C)[C@H]2CC[C@]3(C)O[C@@](C)([C@H](CO)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@H]3[C@]2(C)CC[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H56O14,pos_2_2sodium,664.367006472,USMYUFNGIMZGOD,Terpenoids,Diterpenoids,,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,2,7.0 1946,5953,297,Terpenoids,Diterpenoids,,0.0,MS1_match,UGXGNDFGUYJPTJ-SVVOPOECSA-N,"InChI=1S/C32H56O14/c1-29(2)17-6-10-31(4)18(30(17,3)9-8-20(29)45-28-26(41)24(39)22(37)16(13-34)44-28)7-11-32(5,46-31)19(35)14-42-27-25(40)23(38)21(36)15(12-33)43-27/h15-28,33-41H,6-14H2,1-5H3/t15-,16-,17-,18+,19+,20-,21-,22-,23+,24+,25-,26-,27-,28+,30-,31+,32-/m1/s1",CC1(C)[C@H]2CC[C@]3(C)O[C@@](C)([C@@H](O)CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@H]3[C@]2(C)CC[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H56O14,pos_2_2sodium,664.367006472,UGXGNDFGUYJPTJ,Terpenoids,Diterpenoids,,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,2,7.0 1947,5951,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8282489,ISDB,JLZABDZBCSSSEW-SDRDYGDLSA-N,"InChI=1S/C32H38O19/c1-11-19(37)23(41)27(51-31-28(43)32(44,9-33)10-46-31)30(47-11)45-8-17-20(38)22(40)24(42)29(49-17)50-26-21(39)18-15(36)6-14(35)7-16(18)48-25(26)12-2-4-13(34)5-3-12/h2-7,11,17,19-20,22-24,27-31,33-38,40-44H,8-10H2,1H3/t11-,17+,19-,20-,22-,23+,24+,27+,28-,29-,30+,31-,32+/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@H](O)[C@H]1O,C32H38O19,,726.200728996,JLZABDZBCSSSEW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Chenopodium quinoa,117198.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Atripliceae'],['Chenopodium'],['Chenopodium quinoa'],4,3,8.812995672225952 1948,5947,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.80374086,ISDB,FDCQKWPSJZNODX-KIRCKWRKSA-N,"InChI=1S/C33H40O20/c1-10-19(37)23(41)26(44)31(49-10)47-8-16-20(38)24(42)27(45)32(51-16)48-9-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-14(36)6-13(35)7-15(18)50-29(30)11-2-4-12(34)5-3-11/h2-7,10,16-17,19-21,23-28,31-39,41-46H,8-9H2,1H3/t10-,16-,17-,19-,20-,21+,23+,24+,25+,26+,27-,28-,31-,32-,33+/m0/s1",C[C@@H]1O[C@H](OC[C@@H]2O[C@H](OC[C@@H]3O[C@H](Oc4c(-c5ccc(O)cc5)oc5cc(O)cc(O)c5c4=O)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,,756.21129368,FDCQKWPSJZNODX,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Albizia lebbeck,555517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Albizia'],['Albizia lebbeck'],4,3,8.714963436126709 1949,5945,386,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RNVUDWOQYYWXBJ-IEGSVRCHSA-N,"InChI=1S/C20H18O10/c21-9-3-1-8(2-4-9)18-19(30-20-17(27)15(25)12(24)7-28-20)16(26)14-11(23)5-10(22)6-13(14)29-18/h1-6,12,15,17,20-25,27H,7H2/t12-,15-,17+,20-/m0/s1",O=c1c(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C20H18O10,pos_2_1proton1sodium,418.089996776,RNVUDWOQYYWXBJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,3,7.5 1950,5945,386,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RNVUDWOQYYWXBJ-IEGSVRCHSA-N,"InChI=1S/C20H18O10/c21-9-3-1-8(2-4-9)18-19(30-20-17(27)15(25)12(24)7-28-20)16(26)14-11(23)5-10(22)6-13(14)29-18/h1-6,12,15,17,20-25,27H,7H2/t12-,15-,17+,20-/m0/s1",O=c1c(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C20H18O10,pos_2_1proton1sodium,418.089996776,RNVUDWOQYYWXBJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,3,7.5 1951,5944,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,OFNSUWBAQRCHAV-OYQUVCAXSA-N,"InChI=1S/C40H56O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40+/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@]2(C)C[C@@H](O)CC3(C)C)C(C)(C)C[C@H](O)C1,C40H56O3,pos_1_1proton,584.422945652,OFNSUWBAQRCHAV,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 1952,5943,1773,Terpenoids,Apocarotenoids,Cinnamic acids and derivatives,0.38413644,ISDB,XEVQXKKKAVVSMW-CPCISQLKSA-N,"InChI=1S/C11H16O3/c1-10(2)5-7(12)6-11(3)8(10)4-9(13)14-11/h4,7,12H,5-6H2,1-3H3/t7-,11-/m0/s1",CC1(C)C[C@H](O)C[C@]2(C)OC(=O)C=C12,C11H16O3,,196.109944372,XEVQXKKKAVVSMW,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Monteverdia apurimacensis,5750133.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia apurimacensis'],6,2,8.536545753479004 1953,5941,-1,,,,0.24598637,ISDB,DRDVPYZXOPJSOY-MLVYIAKBSA-N,"InChI=1S/C37H54O16/c1-7-37(6,16-8-9-18(2)3)53-36-30(45)28(43)26(41)23(50-36)17-47-34-31(46)33(52-35-29(44)27(42)25(40)19(4)48-35)32(20(5)49-34)51-24(39)15-12-21-10-13-22(38)14-11-21/h7,9-15,19-20,23,25-36,38,40-46H,1,8,16-17H2,2-6H3/b15-12+/t19-,20-,23+,25-,26+,27+,28-,29+,30+,31+,32-,33-,34+,35-,36-,37-/m0/s1",C=C[C@@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@H](OC(=O)/C=C/c3ccc(O)cc3)[C@@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C37H54O16,,754.341185648,DRDVPYZXOPJSOY,Terpenoids,Sesquiterpenoids,,Eriobotrya deflexa,623252.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Eriobotrya'],['Eriobotrya deflexa'],4,0,4.9839454889297485 1954,5940,-1,,,,0.28266263,ISDB,,,,,,,MJNYHZWCFFQCRW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.130650520324707 1955,5939,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.45777744,ISDB,LTSJTDDQUOUKJT-UHFFFAOYSA-N,"InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-33-29(32)23-21-26-20-22-27(30)28(31)25-26/h20-23,25,30-31H,2-19,24H2,1H3",CCCCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(O)c1,C29H48O4,,460.355260016,LTSJTDDQUOUKJT,,,,Sophora tomentosa,280932.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Sophora'],['Sophora tomentosa'],4,0,5.8311097621917725 1956,5939,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.45777744,ISDB,LTSJTDDQUOUKJT-XTQSDGFTSA-N,"InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-33-29(32)23-21-26-20-22-27(30)28(31)25-26/h20-23,25,30-31H,2-19,24H2,1H3/b23-21+",CCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/c1ccc(O)c(O)c1,C29H48O4,,460.355260016,LTSJTDDQUOUKJT,,,,Glycyrrhiza inflata,284049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza inflata'],4,0,5.8311097621917725 1957,5939,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.45777744,ISDB,LTSJTDDQUOUKJT-UHFFFAOYSA-N,"InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-33-29(32)23-21-26-20-22-27(30)28(31)25-26/h20-23,25,30-31H,2-19,24H2,1H3",CCCCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(O)c1,C29H48O4,,460.355260016,LTSJTDDQUOUKJT,,,,Glycyrrhiza glabra,554264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza glabra'],4,0,5.8311097621917725 1958,5937,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.7176119,ISDB,BXBVPYSHEOQGHP-UHFFFAOYSA-N,"InChI=1S/C17H26O4/c1-13(2)7-5-4-6-8-17(19)21-12-14-9-10-15(18)16(11-14)20-3/h9-11,13,18H,4-8,12H2,1-3H3",COc1cc(COC(=O)CCCCCC(C)C)ccc1O,C17H26O4,,294.183109312,BXBVPYSHEOQGHP,Alkaloids,Pseudoalkaloids,Capsaicins and Capsaicinoids,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,0,6.870447635650635 1959,5936,-1,,,,0.34206358,ISDB,MEIJIKXWOMTKCH-SDNRFBISSA-N,"InChI=1S/C28H44O3/c1-16(2)17(3)7-8-18(4)20-9-10-21-23-22(12-13-26(20,21)5)27(6)14-11-19(29)15-28(27)25(31-28)24(23)30/h7-8,16-20,22,24-25,29-30H,9-15H2,1-6H3/b8-7+/t17-,18+,19-,20+,22-,24-,25-,26+,27+,28-/m0/s1",CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CCC2=C3[C@H](O)[C@@H]4O[C@@]45C[C@@H](O)CC[C@]5(C)[C@H]3CC[C@@]21C,C28H44O3,,428.329045268,MEIJIKXWOMTKCH,Terpenoids,Steroids,Cholestane steroids,Momordica charantia,955521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Momordiceae'],['Momordica'],['Momordica charantia'],4,0,5.36825430393219 1960,5934,435,Amino acids and Peptides,Oligopeptides,Linear peptides,0.36374122,ISDB,JZHHEDXKUYAXEI-XEOSYUJQSA-N,"InChI=1S/C49H82N8O15/c1-14-27(6)39(60)29(8)24-30(9)40-28(7)19-20-49(70,72-40)48(12,69)47(68)53-37(38(59)26(4)5)45(65)56-34(18-16-22-51-56)44(64)57(71)31(10)42(62)54(13)35(23-25(2)3)43(63)55-33(17-15-21-50-55)41(61)52-36(32(11)58)46(66)67/h14,24-26,28-29,31-38,40,50-51,58-59,69-71H,15-23H2,1-13H3,(H,52,61)(H,53,68)(H,66,67)/b27-14+,30-24+/t28-,29-,31-,32-,33-,34+,35+,36+,37-,38-,40-,48?,49+/m0/s1",C/C=C(\C)C(=O)[C@@H](C)/C=C(\C)[C@H]1O[C@@](O)(C(C)(O)C(=O)N[C@H](C(=O)N2NCCC[C@@H]2C(=O)N(O)[C@@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2NCCC[C@H]2C(=O)N[C@@H](C(=O)O)[C@H](C)O)[C@@H](O)C(C)C)CC[C@@H]1C,C49H82N8O15,,1022.589963924,JZHHEDXKUYAXEI,Amino acids and Peptides,Oligopeptides,Linear peptides,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,3,2.9549648761749268 1961,5932,402,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.27223828,ISDB,,,,,,,ULAWVOLPXLRQGQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0889531373977661 1962,5931,718,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,0.43914834,ISDB,GVJHHUAWPYXKBD-IHMCZWCLSA-N,"InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29+/m0/s1",Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)O2,C29H50O2,,430.3810808399999,GVJHHUAWPYXKBD,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,9.256593346595764 1963,5927,-1,,,,0.21432738,ISDB,,,,,,,PFUAPHKFBUJYBS,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8573095202445984 1964,5926,-1,,,,0.0,MS1_match,ZHXZFMUKNSGMQD-KJOFTPIDSA-N,"InChI=1S/C29H44O10/c1-14-23(33)24(34)25(35)26(38-14)39-17-5-7-28(13-30)16(10-17)3-4-19-22(28)20(31)11-27(2)18(6-8-29(19,27)36)15-9-21(32)37-12-15/h9,14,16-20,22-26,30-31,33-36H,3-8,10-13H2,1-2H3/t14-,16-,17+,18-,19-,20-,22-,23+,24-,25-,26+,27-,28-,29+/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(CO)[C@H](CC[C@@H]4[C@@H]3[C@H](O)C[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)[C@H](O)[C@H](O)[C@H]1O,C29H44O10,pos_2_1proton1potassium,552.293447608,ZHXZFMUKNSGMQD,Terpenoids,Steroids,Cardenolides,Crossopetalum gaumeri,1091453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Crossopetalum'],['Crossopetalum gaumeri'],6,0,6.0 1965,5925,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.0,MS1_match,UOLUQSRSSLEMQA-POFXHGHASA-N,"InChI=1S/C22H36O3/c1-4-24-18-19(2)9-5-10-22(14-25-18)16(19)8-11-21-12-15(6-7-17(21)22)20(3,23)13-21/h15-18,23H,4-14H2,1-3H3/t15-,16-,17-,18+,19-,20-,21+,22+/m1/s1",CCO[C@H]1OC[C@@]23CCC[C@]1(C)[C@H]2CC[C@@]12C[C@@H](CC[C@H]13)[C@](C)(O)C2,C22H36O3,pos_1_1proton,348.266445012,UOLUQSRSSLEMQA,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 1966,5922,-1,,,,0.0,MS1_match,JUJTUEBXXGRSJB-MTAKFWDWSA-N,"InChI=1S/C17H26O9/c1-3-9-10-4-12(22-2)23-6-8(10)7-24-16(9)26-17-15(21)14(20)13(19)11(5-18)25-17/h3,7,9-21H,1,4-6H2,2H3/t9-,10-,11-,12-,13-,14+,15-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2CO[C@@H](OC)C[C@H]21,C17H26O9,pos_1_1proton1acetonitrile,374.1576824119999,JUJTUEBXXGRSJB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 1967,5916,-1,,,,0.51270854,ISDB,,,,,,,JQSVUYIPZVCSHT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.0508341789245605 1968,5904,788,Terpenoids,Steroids,Cholestane steroids,0.44776604,ISDB,DPKBLLFCUGWECD-GTYQNAEWSA-N,"InChI=1S/C28H46O3/c1-18-19(29)7-8-20-24(18,3)10-9-21-25(20,4)12-13-27(6)22-17-23(2,30)11-15-28(22,31)16-14-26(21,27)5/h18,20-22,30-31H,7-17H2,1-6H3/t18-,20+,21-,22-,23+,24+,25-,26+,27-,28-/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)CC[C@]3(O)CC[C@]12C,C28H46O3,,430.344695332,DPKBLLFCUGWECD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,1,9.291064143180847 1969,5897,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1methanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1970,5897,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1methanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 1971,5897,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1methanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,0,6.0 1972,5897,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1methanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 1973,5897,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1methanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,0,6.0 1974,5895,-1,,,,0.0,MS1_match,BKATZVAUANSCKN-QWRGUYRKSA-N,"InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1",CC(=O)OCC1=CC[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_2MK,194.130679816,BKATZVAUANSCKN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1975,5895,-1,,,,0.0,MS1_match,PBWRFXQNNGSAQG-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3",C=C1C(OC(C)=O)CC2(C(C)C)CC12,C12H18O2,pos_2MK,194.130679816,PBWRFXQNNGSAQG,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1976,5895,-1,,,,0.0,MS1_match,ALVJDUNBMKMTDC-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-12(2,3)10-8-9(13-4)6-7-11(10)14-5/h6-8H,1-5H3",COc1ccc(OC)c(C(C)(C)C)c1,C12H18O2,pos_2MK,194.130679816,ALVJDUNBMKMTDC,Shikimates and Phenylpropanoids,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1977,5895,-1,,,,0.0,MS1_match,RWENJYLCELUBAE-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-8(2)10-6-11(13-4)9(3)12(7-10)14-5/h6-8H,1-5H3",COc1cc(C(C)C)cc(OC)c1C,C12H18O2,pos_2MK,194.130679816,RWENJYLCELUBAE,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1978,5895,-1,,,,0.0,MS1_match,GVZSSHYAFJPRJY-GARJFASQSA-N,"InChI=1S/C12H18O2/c1-7-10-5-9(12(7,3)4)6-11(10)14-8(2)13/h9-11H,1,5-6H2,2-4H3/t9-,10-,11+/m0/s1",C=C1[C@@H]2C[C@@H](C[C@H]2OC(C)=O)C1(C)C,C12H18O2,pos_2MK,194.130679816,GVZSSHYAFJPRJY,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1979,5895,-1,,,,0.0,MS1_match,OZBFUQLOVFXDNK-VWYCJHECSA-N,"InChI=1S/C12H18O2/c1-7-5-11(14-8(2)13)10-6-9(7)12(10,3)4/h5,9-11H,6H2,1-4H3/t9-,10+,11+/m1/s1",CC(=O)O[C@H]1C=C(C)[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_2MK,194.130679816,OZBFUQLOVFXDNK,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 1980,5894,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,AOCLIMDHBMBYGD-NQWMYEDTSA-N,"InChI=1S/C16H28O2/c1-10-8-12(17)13-15(10,4)9-11-6-7-16(13,5)18-14(11,2)3/h10-13,17H,6-9H2,1-5H3/t10-,11-,12-,13-,15-,16+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@]1(C)C[C@H]1CC[C@]2(C)OC1(C)C,C16H28O2,pos_2_1proton1sodium,252.208930136,AOCLIMDHBMBYGD,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 1981,5893,1166,Polyketides,Fatty esters,Wax monoesters,0.49237487,ISDB,GFTJDZSXIJIXDB-ARNLJNQMSA-N,"InChI=1S/C25H44O4/c1-4-6-8-10-12-14-15-17-19-21-23-25(3,29-24(21)26)28-22(27-23)20-18-16-13-11-9-7-5-2/h19,22-23H,4-18,20H2,1-3H3/t22-,23+,25-/m0/s1",CCCCCCCCCC=C1C(=O)O[C@]2(C)O[C@@H](CCCCCCCCC)O[C@H]12,C25H44O4,,408.323959888,GFTJDZSXIJIXDB,Polyketides,,,Litsea acutivena,18346.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Litsea'],['Litsea acutivena'],4,1,6.469499468803406 1982,5891,38,Terpenoids,Steroids,Cholestane steroids,0.6222751,ISDB,GQVCGTRDXSDAHC-UHFFFAOYSA-N,"InChI=1S/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3",COC1C=C2C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC2C2(C)CCC(O)CC12O,C29H48O3,,444.360345396,GQVCGTRDXSDAHC,Terpenoids,Steroids,Cholestane steroids,Trewia nudiflora,375532.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus nudiflorus'],4,3,7.989100456237793 1983,5891,38,Terpenoids,Steroids,Cholestane steroids,0.6222751,ISDB,GQVCGTRDXSDAHC-DDUFMXSOSA-N,"InChI=1S/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24-,25-,26-,27+,28+,29-/m0/s1",CO[C@H]1C=C2[C@@H]3CC[C@H]([C@H](C)/C=C/[C@H](C)C(C)C)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC[C@H](O)C[C@]12O,C29H48O3,,444.360345396,GQVCGTRDXSDAHC,Terpenoids,Steroids,Cholestane steroids,Mallotus nudiflorus,375532.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus nudiflorus'],4,3,7.989100456237793 1984,5888,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.3220477,ISDB,YVMUBJPWZKUGBC-OOBAEQHESA-N,"InChI=1S/C22H30O11/c1-22(2,33-21-19(28)18(27)17(26)14(9-23)32-21)15(24)7-11-12(29-3)8-13-10(20(11)30-4)5-6-16(25)31-13/h5-6,8,14-15,17-19,21,23-24,26-28H,7,9H2,1-4H3/t14-,15+,17-,18+,19-,21+/m1/s1",COc1cc2oc(=O)ccc2c(OC)c1C[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H30O11,,470.1788117799998,YVMUBJPWZKUGBC,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Toddalia asiatica,232693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Toddalia'],['Toddalia asiatica'],4,0,5.288190841674805 1985,5887,-1,,,,0.0,MS1_match,FKUPPRZPSYCDRS-UHFFFAOYSA-N,InChI=1S/C15H28O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h1-14H2,O=C1CCCCCCCCCCCCCCO1,C15H28O2,pos_1_1potassium,240.208930136,FKUPPRZPSYCDRS,Fatty acids,Fatty esters,Lactones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 1986,5884,-1,,,,0.265197,ISDB,,,,,,,QCRRQAUQXBDWDH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0607880353927612 1987,5883,647,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,0.46570587,ISDB,DOJXTMYNRCGFBG-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-13-3-2-12-4-6-20-7-5-16(21)14-8-17-18(24-11-23-17)9-15(14)19(12,20)10-13/h2-4,8-9,13H,5-7,10-11H2,1H3",COC1C=CC2=CCN3CCC(=O)c4cc5c(cc4C23C1)OCO5,C19H19NO4,,325.131408088,DOJXTMYNRCGFBG,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Kuntheria pedunculata,705887.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Colchicaceae'],['Unknown'],['Kuntheria'],['Kuntheria pedunculata'],4,3,7.362823486328125 1988,5881,788,Terpenoids,Steroids,Cholestane steroids,0.58674335,ISDB,HGCLEPLEUUJGID-REBIDWDSSA-N,"InChI=1S/C27H44O3/c1-17(2)7-6-8-18(3)20-9-10-21-22-16-24(29)23-15-19(28)11-12-26(23,5)27(22,30)14-13-25(20,21)4/h16-21,23,28,30H,6-15H2,1-5H3/t18-,19+,20-,21+,23-,25-,26+,27-/m1/s1",CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@@]3(O)CC[C@]12C,C27H44O3,,416.329045268,HGCLEPLEUUJGID,Terpenoids,Steroids,Cholestane steroids,Peniocereus viperinus,700179.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Cactaceae'],['Echinocereeae'],['Peniocereus'],['Peniocereus viperinus'],4,3,7.846973419189453 1989,5880,-1,,,,0.47069895,ISDB,FQIADTNEIOLURP-GRLWGSQLSA-N,"InChI=1S/C14H19NO5/c1-18-10-3-5-15-11(6-10)14-7-9(16)2-4-13(14,20-15)8-12(17)19-14/h2,4,9-11,16H,3,5-8H2,1H3/t9-,10-,11-,13-,14-/m0/s1",CO[C@H]1CCN2O[C@]34C=C[C@H](O)C[C@]3(OC(=O)C4)[C@@H]2C1,C14H19NO5,,281.12632270800003,FQIADTNEIOLURP,Alkaloids,,,Flueggea suffruticosa,351504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Flueggea'],['Flueggea suffruticosa'],4,0,5.882795810699463 1990,5877,-1,,,,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_2MNa,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 1991,5875,293,Polyketides,Aromatic polyketides,Dammarane and Protostane triterpenoids,0.48126298,ISDB,ZWERVKPIXLXNTP-YXDDMCJOSA-N,"InChI=1S/C30H48O8/c1-3-21(2)25(37-30-29(36)28(35)27(34)26(20-31)38-30)16-14-12-10-8-6-4-5-7-9-11-13-15-22-17-23(32)19-24(33)18-22/h5,7,9,11,17-19,21,25-36H,3-4,6,8,10,12-16,20H2,1-2H3/b7-5+,11-9+/t21-,25+,26+,27+,28-,29+,30-/m0/s1",CC[C@H](C)[C@@H](CCCCCCC/C=C/C=C/CCc1cc(O)cc(O)c1)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C30H48O8,,536.3349184959998,ZWERVKPIXLXNTP,Polyketides,Aromatic polyketides,Depsides,Penicillium simplicissimum,968742.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium simplicissimum'],1,2,3.9250519275665283 1992,5875,293,Polyketides,Aromatic polyketides,Dammarane and Protostane triterpenoids,0.48126298,ISDB,ZWERVKPIXLXNTP-YXDDMCJOSA-N,"InChI=1S/C30H48O8/c1-3-21(2)25(37-30-29(36)28(35)27(34)26(20-31)38-30)16-14-12-10-8-6-4-5-7-9-11-13-15-22-17-23(32)19-24(33)18-22/h5,7,9,11,17-19,21,25-36H,3-4,6,8,10,12-16,20H2,1-2H3/b7-5+,11-9+/t21-,25+,26+,27+,28-,29+,30-/m0/s1",CC[C@H](C)[C@@H](CCCCCCC/C=C/C=C/CCc1cc(O)cc(O)c1)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C30H48O8,,536.3349184959998,ZWERVKPIXLXNTP,Polyketides,Aromatic polyketides,Depsides,Penicillium janthinellum,226477.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium janthinellum'],1,2,3.9250519275665283 1993,5875,293,Polyketides,Aromatic polyketides,Dammarane and Protostane triterpenoids,0.48126298,ISDB,ZWERVKPIXLXNTP-YXDDMCJOSA-N,"InChI=1S/C30H48O8/c1-3-21(2)25(37-30-29(36)28(35)27(34)26(20-31)38-30)16-14-12-10-8-6-4-5-7-9-11-13-15-22-17-23(32)19-24(33)18-22/h5,7,9,11,17-19,21,25-36H,3-4,6,8,10,12-16,20H2,1-2H3/b7-5+,11-9+/t21-,25+,26+,27+,28-,29+,30-/m0/s1",CC[C@H](C)[C@@H](CCCCCCC/C=C/C=C/CCc1cc(O)cc(O)c1)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C30H48O8,,536.3349184959998,ZWERVKPIXLXNTP,Polyketides,Aromatic polyketides,Depsides,Penicillium ianthinellum,82948.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium ianthinellum'],1,2,3.9250519275665283 1994,5872,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.20173518,ISDB,,,,,,,IDYUGMBNBDIUCX,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8069407343864441 1995,5871,948,Terpenoids,Sesquiterpenoids,Chamigrane sesquiterpenoids,0.5200358,ISDB,PNIQVCYAORGJMD-UHFFFAOYSA-N,"InChI=1S/C13H20O2/c1-10(2)6-5-9(14)12(4)13(10)8-7-11(13,3)15-12/h7-9,14H,5-6H2,1-4H3",CC1(C)CCC(O)C2(C)OC3(C)C=CC132,C13H20O2,,208.14632988,PNIQVCYAORGJMD,Terpenoids,Sesquiterpenoids,Chamigrane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],0,3,3.5801432132720947 1996,5868,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.30748734,ISDB,,,,,,,DJPVXOYGQKTRPA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2299493551254272 1997,5867,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.0,MS1_match,LTRLDPJSMLPKMF-YKXWAFRCSA-N,"InChI=1S/C25H40O10/c1-12-9-14(26)10-25(3,4)15(12)6-5-13(2)34-24-23(32)22(31)21(30)18(35-24)11-33-17-8-7-16(27)19(28)20(17)29/h5-6,9,13,15-24,27-32H,7-8,10-11H2,1-4H3/b6-5+/t13-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2CC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O10,pos_2_1proton1potassium,500.26214748,LTRLDPJSMLPKMF,Terpenoids,Apocarotenoids,Megastigmanes,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 1998,5865,-1,,,,0.0,MS1_match,FILRFEXGRQEKMM-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)14(7)23-5-8(6)18)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1potassium,362.157682412,FILRFEXGRQEKMM,Terpenoids,Monoterpenoids,,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 1999,5865,-1,,,,0.0,MS1_match,DPBCFTHDJGXWRI-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(19)16(2,14(7)23-5-8(6)18)25-15-13(22)12(21)11(20)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1potassium,362.157682412,DPBCFTHDJGXWRI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2000,5865,-1,,,,0.0,MS1_match,DBLVGADGVDUSHJ-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1potassium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2001,5865,-1,,,,0.0,MS1_match,DBLVGADGVDUSHJ-RLIMOHGTSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7+,8-,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1potassium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 2002,5865,-1,,,,0.0,MS1_match,RAKWYUWXLTYDQR-LTPIHACHSA-N,"InChI=1S/C16H26O9/c1-6-7-2-10(8(3-17)9(7)5-23-15(6)22)24-16-14(21)13(20)12(19)11(4-18)25-16/h6-14,16-21H,2-5H2,1H3/t6-,7-,8-,9+,10+,11-,12-,13+,14-,16-/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]21,C16H26O9,pos_1_1potassium,362.157682412,RAKWYUWXLTYDQR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 2003,5865,-1,,,,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1potassium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2004,5865,-1,,,,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1potassium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2005,5862,429,Polyketides,Phloroglucinols,Acyl phloroglucinols,0.5173213,ISDB,SFMNMSZFHGJDAG-UHFFFAOYSA-N,"InChI=1S/C14H12O6/c1-20-10-5-11(17)13(12(18)6-10)14(19)7-2-8(15)4-9(16)3-7/h2-6,15-18H,1H3",COc1cc(O)c(C(=O)c2cc(O)cc(O)c2)c(O)c1,C14H12O6,,276.063388104,SFMNMSZFHGJDAG,Polyketides,Phloroglucinols,Acyl phloroglucinols,Hypericum annulatum,541328.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum annulatum'],4,3,7.569285154342651 2006,5859,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7379698,ISDB,,,,,,,IZAXLQJAMBHSAA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.9518792629241943 2007,5858,618,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.49874043,ISDB,BEEHSERCPMYOCS-NYJVQORESA-N,"InChI=1S/C29H36O12/c1-13(30)41-27-12-24(2)19(18(32)23(35)38-5)26(27,4)15-6-8-25(3)22(14-7-9-39-11-14)40-16(31)10-28(25,36)29(15,37)21(34)17(27)20(24)33/h7,9,11,15,17-19,21-22,32,34,36-37H,6,8,10,12H2,1-5H3/t15-,17-,18-,19+,21+,22+,24-,25+,26-,27+,28-,29+/m1/s1",COC(=O)[C@H](O)[C@@H]1[C@@]2(C)[C@H]3CC[C@@]4(C)[C@H](c5ccoc5)OC(=O)C[C@]4(O)[C@@]3(O)[C@@H](O)[C@H]3C(=O)[C@]1(C)C[C@]32OC(C)=O,C29H36O12,,576.220676592,BEEHSERCPMYOCS,Terpenoids,Triterpenoids,Limonoids,Khaya senegalensis,923412.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Khaya'],['Khaya senegalensis'],4,1,6.494961738586426 2008,5857,74,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.95393395,ISDB,NAEGEZSNSCUUHE-TYCAOWMRSA-N,"InChI=1S/C15H16O10/c16-4-7-10(19)11(20)13(22)15(24-7)23-6-3-5-1-2-8(17)25-14(5)12(21)9(6)18/h1-3,7,10-11,13,15-16,18-22H,4H2/t7-,10-,11+,13-,15-/m1/s1",O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c(O)c2o1,C15H16O10,,356.074346712,NAEGEZSNSCUUHE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,3,9.315735816955566 2009,5852,1160,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,0.40267992,ISDB,YGAQHKHUPCQICU-UTICBQDHSA-N,"InChI=1S/C21H32O9/c1-8-4-12-10(9(2)18(26)27-12)6-21-11(8)5-14(20(21,3)30-21)29-19-17(25)16(24)15(23)13(7-22)28-19/h8-17,19,22-25H,4-7H2,1-3H3/t8-,9+,10+,11-,12-,13+,14+,15+,16-,17+,19-,20+,21-/m0/s1",C[C@H]1C[C@@H]2OC(=O)[C@H](C)[C@H]2C[C@@]23O[C@]2(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@H]13,C21H32O9,,428.204632604,YGAQHKHUPCQICU,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Pentanema divaricatum,123936.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pentanema'],['Pentanema divaricatum'],4,3,7.110719680786133 2010,5852,1160,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,0.40267992,ISDB,YGAQHKHUPCQICU-UTICBQDHSA-N,"InChI=1S/C21H32O9/c1-8-4-12-10(9(2)18(26)27-12)6-21-11(8)5-14(20(21,3)30-21)29-19-17(25)16(24)15(23)13(7-22)28-19/h8-17,19,22-25H,4-7H2,1-3H3/t8-,9+,10+,11-,12-,13+,14+,15+,16-,17+,19-,20+,21-/m0/s1",C[C@H]1C[C@@H]2OC(=O)[C@H](C)[C@H]2C[C@@]23O[C@]2(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@H]13,C21H32O9,,428.204632604,YGAQHKHUPCQICU,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Vicoa divaricata,123936.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pentanema'],['Pentanema divaricatum'],4,3,7.110719680786133 2011,5850,1133,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1ammonium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 2012,5850,1133,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1ammonium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 2013,5848,-1,,,,0.0,MS1_match,SQWBLOVFMFTTHY-CUQQVVPFSA-N,"InChI=1S/C26H31NO13/c1-2-15-16(6-5-13-8-14(23(34)35)10-27(9-13)7-3-4-19(29)30)17(24(36)37)12-38-25(15)40-26-22(33)21(32)20(31)18(11-28)39-26/h2,5-6,8-10,12,15-16,18,20-22,25-26,28,31-33H,1,3-4,7,11H2,(H2-,29,30,34,35,36,37)/b6-5+/t15-,16+,18-,20-,21+,22-,25+,26+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1cc(C(=O)O)c[n+](CCCC(=O)O)c1,C26H31NO13,pos_1_1proton1methanol,565.179540052,SQWBLOVFMFTTHY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 2014,5848,-1,,,,0.0,MS1_match,XQVQOVDNWBXCHM-HBGFXZTGSA-N,"InChI=1S/C25H32O14/c1-7-16-17(8-9-26)18(23(31)32-6)10-34-24(16)39-25-22(37-15(5)30)21(36-14(4)29)20(35-13(3)28)19(38-25)11-33-12(2)27/h7,9-10,16-17,19-22,24-25H,1,8,11H2,2-6H3/t16?,17?,19-,20-,21+,22-,24+,25+/m1/s1",C=CC1C(CC=O)C(C(=O)OC)=CO[C@H]1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C25H32O14,pos_1_1proton1acetonitrile,556.179205704,XQVQOVDNWBXCHM,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 2015,5846,389,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,0.80324256,ISDB,WUKVVZRDLIZYGM-UHFFFAOYSA-N,"InChI=1S/C16H17NO4/c1-17-5-4-8-2-3-13-14(15(8)17)9-6-11(18)12(19)7-10(9)16(20)21-13/h2,6-7,13-15,18-19H,3-5H2,1H3",CN1CCC2=CCC3OC(=O)c4cc(O)c(O)cc4C3C21,C16H17NO4,,287.115758024,WUKVVZRDLIZYGM,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Narcissus papyraceus,625035.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Narcissus'],['Narcissus papyraceus'],4,3,8.71297025680542 2016,5842,-1,,,,0.0,MS1_match,AQOVEYNSQFBSQX-STMBSLSDSA-N,"InChI=1S/C16H20O5/c1-4-13(11-17)16(18)21-9-5-6-12-7-8-14(19-2)15(10-12)20-3/h4-8,10,17H,9,11H2,1-3H3/b6-5+,13-4-",C/C=C(/CO)C(=O)OC/C=C/c1ccc(OC)c(OC)c1,C16H20O5,pos_2MNa,292.13107374,AQOVEYNSQFBSQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 2017,5840,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.24051662,ISDB,MWDFPCUZRNPYPD-PDPGQQONSA-N,"InChI=1S/C40H56O5/c1-22(2)24-17-26-28(19-30(24)42)40(10)16-12-14-38(7,8)35(40)34-33(26)44-36(45-34)27-18-25(23(3)4)31(43)20-29(27)39(9)15-11-13-37(5,6)32(39)21-41/h17-23,32-36,42-43H,11-16H2,1-10H3/t32-,33+,34-,35-,36+,39+,40+/m0/s1",CC(C)c1cc([C@H]2O[C@H]3[C@H](O2)c2cc(C(C)C)c(O)cc2[C@@]2(C)CCCC(C)(C)[C@H]32)c([C@@]2(C)CCCC(C)(C)[C@@H]2C=O)cc1O,C40H56O5,,616.412774892,MWDFPCUZRNPYPD,Terpenoids,Diterpenoids,Abietane diterpenoids,Pinalia japonica,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,1,5.462066471576691 2018,5840,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.24051662,ISDB,MWDFPCUZRNPYPD-PDPGQQONSA-N,"InChI=1S/C40H56O5/c1-22(2)24-17-26-28(19-30(24)42)40(10)16-12-14-38(7,8)35(40)34-33(26)44-36(45-34)27-18-25(23(3)4)31(43)20-29(27)39(9)15-11-13-37(5,6)32(39)21-41/h17-23,32-36,42-43H,11-16H2,1-10H3/t32-,33+,34-,35-,36+,39+,40+/m0/s1",CC(C)c1cc([C@H]2O[C@H]3[C@H](O2)c2cc(C(C)C)c(O)cc2[C@@]2(C)CCCC(C)(C)[C@H]32)c([C@@]2(C)CCCC(C)(C)[C@@H]2C=O)cc1O,C40H56O5,,616.412774892,MWDFPCUZRNPYPD,Terpenoids,Diterpenoids,Abietane diterpenoids,Conchidium japonicum,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,1,5.462066471576691 2019,5836,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.45616907,ISDB,VEVKLOLYYQLRRV-UHFFFAOYSA-N,"InChI=1S/C30H48O/c1-19(2)20-11-15-27(5)21(20)12-17-29(7)23(27)9-10-24-28(6)16-14-25(31)26(3,4)22(28)13-18-30(24,29)8/h20-24H,1,9-18H2,2-8H3",C=C(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCC(=O)C(C)(C)C3CCC21C,C30H48O,,424.3705161559999,VEVKLOLYYQLRRV,Terpenoids,Triterpenoids,Hopane and Moretane triterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,2,8.824676275253296 2020,5831,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29383662,ISDB,BFSRJRKZZSIEFP-MOHLSBLISA-N,"InChI=1S/C30H46O2/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-20-25(3,4)23(31)10-11-26(20,5)21(27)9-13-30(28,32-19-29)22(29)18-24/h9,13,20-22H,8,10-12,14-19H2,1-7H3/t20-,21-,22-,26+,27-,28+,29-,30-/m1/s1",CC1(C)CC[C@@]23CC[C@@]4(C)[C@]5(C)CC[C@@H]6C(C)(C)C(=O)CC[C@]6(C)[C@H]5C=C[C@@]4(OC2)[C@@H]3C1,C30H46O2,,438.349780712,BFSRJRKZZSIEFP,Terpenoids,Triterpenoids,Oleanane triterpenoids,Viburnum odoratissimum var. awabuki,90825.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum awabuki'],5,3,7.675346493721008 2021,5830,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MNa,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2022,5830,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MNa,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 2023,5830,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MNa,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2024,5830,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MNa,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2025,5830,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MNa,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 2026,5830,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MNa,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2027,5830,-1,,,,0.0,MS1_match,OEGZSLZSZBSXQC-PBSSREKVSA-N,"InChI=1S/C16H22O8/c1-7(2)12(18)23-14-11-15(19)5-10(22-9(4)17)16(11,20)6-21-13(24-14)8(15)3/h7,10-11,13-14,19-20H,3,5-6H2,1-2,4H3/t10-,11-,13+,14+,15-,16-/m0/s1",C=C1[C@@H]2OC[C@]3(O)[C@@H](OC(C)=O)C[C@@]1(O)[C@@H]3[C@H](OC(=O)C(C)C)O2,C16H22O8,pos_2MNa,342.131467664,OEGZSLZSZBSXQC,Terpenoids,Monoterpenoids,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2028,5827,1581,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.32390332,ISDB,AOXSSLNAZRFCMH-HXMTWWTKSA-N,"InChI=1S/C42H46O23/c1-15-28(49)34(55)39(65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-3-16-2-8-20(45)21(46)10-16)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-4-6-18(44)7-5-17)38(31(27)52)64-40-35(56)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-3+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O23,,918.242987732,AOXSSLNAZRFCMH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,8.795613288879395 2029,5827,1581,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.32390332,ISDB,AOXSSLNAZRFCMH-HXMTWWTKSA-N,"InChI=1S/C42H46O23/c1-15-28(49)34(55)39(65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-3-16-2-8-20(45)21(46)10-16)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-4-6-18(44)7-5-17)38(31(27)52)64-40-35(56)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-3+/t15-,24+,25+,28-,29+,30+,32-,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C42H46O23,,918.242987732,AOXSSLNAZRFCMH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum chiisanense,921879.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chiisanense'],6,3,8.795613288879395 2030,5826,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.37924913,ISDB,IIRBCWLZHUJBBE-FQEVSTJZSA-N,"InChI=1S/C33H31NO7/c1-7-32(2,3)25-29-17(12-13-22(35)40-29)27(36)24-20(15-33(4,5)41-30(24)25)23-19(31(38)39-6)14-18-16-10-8-9-11-21(16)34-26(18)28(23)37/h7-14,20,34,36-37H,1,15H2,2-6H3/t20-/m0/s1",C=CC(C)(C)c1c2c(c(O)c3ccc(=O)oc13)[C@H](c1c(C(=O)OC)cc3c([nH]c4ccccc43)c1O)CC(C)(C)O2,C33H31NO7,,553.210052332,IIRBCWLZHUJBBE,Shikimates and Phenylpropanoids,Coumarins,Pyranocoumarins,Clausena excavata,571298.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Clausena'],['Clausena excavata'],4,0,5.516996502876282 2031,5823,150,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.27859196,ISDB,,,,,,,KUYOOBCAZIUXQE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1143678426742554 2032,5822,389,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,0.8188029,ISDB,GGLBCWZWKMDRKD-NOLJZWGESA-N,"InChI=1S/C16H19NO2/c1-17-8-7-16-6-5-12(18)9-14(16)19-13-4-2-3-11(10-17)15(13)16/h2-6,12,14,18H,7-10H2,1H3/t12-,14-,16-/m0/s1",CN1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2cccc(c23)C1,C16H19NO2,,257.141578848,GGLBCWZWKMDRKD,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Lycoris radiata,488729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Lycoris'],['Lycoris radiata'],4,3,8.775211572647095 2033,5821,801,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,ZYGHJZDHTFUPRJ-UHFFFAOYSA-N,InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,O=c1ccc2ccccc2o1,C9H6O2,pos_1_1proton,146.036779432,ZYGHJZDHTFUPRJ,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,3,7.5 2034,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,0,6.0 2035,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.0 2036,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 2037,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-UHFFFAOYSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2",O=c1c(OC2OC(CO)C(O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799999,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 2038,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,0,6.0 2039,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,0,6.0 2040,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,0,6.0 2041,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,0,6.0 2042,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,0,6.0 2043,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,0,6.0 2044,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,0,6.0 2045,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lepuropetalon spathulatum,78653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lepuropetalon'],['Lepuropetalon spathulatum'],6,0,6.0 2046,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,0,6.0 2047,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 2048,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.0 2049,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 2050,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-UHFFFAOYSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2",O=c1c(OC2OC(CO)C(O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799999,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 2051,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,0,6.0 2052,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 2053,5820,-1,,,,0.0,MS1_match,DCYOADKBABEMIQ-OWMUPTOHSA-N,"InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,C21H20O12,pos_1_1proton,464.0954760799998,DCYOADKBABEMIQ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,0,6.0 2054,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,0,6.0 2055,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,0,6.0 2056,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,0,6.0 2057,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,0,6.0 2058,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,0,6.0 2059,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,0,6.0 2060,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,0,6.0 2061,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lepuropetalon spathulatum,78653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lepuropetalon'],['Lepuropetalon spathulatum'],6,0,6.0 2062,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,0,6.0 2063,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 2064,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.0 2065,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 2066,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-UHFFFAOYSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2",O=c1c(OC2OC(CO)C(O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799999,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 2067,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,0,6.0 2068,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,0,6.0 2069,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,0,6.0 2070,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,0,6.0 2071,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,0,6.0 2072,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,0,6.0 2073,5820,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lepuropetalon spathulatum,78653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lepuropetalon'],['Lepuropetalon spathulatum'],6,0,6.0 2074,5820,-1,,,,0.0,MS1_match,DCYOADKBABEMIQ-OWMUPTOHSA-N,"InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,C21H20O12,pos_1_1proton,464.0954760799998,DCYOADKBABEMIQ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,0,6.0 2075,5819,-1,,,,0.68586093,ISDB,QTZPBQMTXNEKRX-UZZXJJOXSA-N,"InChI=1S/C22H28N2O5/c1-12(25)15-8-13-10-21(20(27)29-3)18(15)24(11-13)7-6-22(21)19(26)16-9-14(28-2)4-5-17(16)23-22/h4-5,9,12-13,15,18,23,25H,6-8,10-11H2,1-3H3/t12-,13-,15-,18+,21-,22-/m0/s1",COC(=O)[C@]12C[C@@H]3C[C@@H]([C@H](C)O)[C@H]1N(CC[C@@]21Nc2ccc(OC)cc2C1=O)C3,C22H28N2O5,,400.199821996,QTZPBQMTXNEKRX,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Haemanthus montanus,991992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Haemanthus'],['Haemanthus montanus'],4,0,6.743443727493286 2076,5819,-1,,,,0.68586093,ISDB,QTZPBQMTXNEKRX-UZZXJJOXSA-N,"InChI=1S/C22H28N2O5/c1-12(25)15-8-13-10-21(20(27)29-3)18(15)24(11-13)7-6-22(21)19(26)16-9-14(28-2)4-5-17(16)23-22/h4-5,9,12-13,15,18,23,25H,6-8,10-11H2,1-3H3/t12-,13-,15-,18+,21-,22-/m0/s1",COC(=O)[C@]12C[C@@H]3C[C@@H]([C@H](C)O)[C@H]1N(CC[C@@]21Nc2ccc(OC)cc2C1=O)C3,C22H28N2O5,,400.199821996,QTZPBQMTXNEKRX,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Tabernaemontana rupicola,11073.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Tabernaemontaneae'],['Tabernaemontana'],['Tabernaemontana rupicola'],4,0,6.743443727493286 2077,5819,-1,,,,0.68586093,ISDB,QTZPBQMTXNEKRX-UHFFFAOYSA-N,"InChI=1S/C22H28N2O5/c1-12(25)15-8-13-10-21(20(27)29-3)18(15)24(11-13)7-6-22(21)19(26)16-9-14(28-2)4-5-17(16)23-22/h4-5,9,12-13,15,18,23,25H,6-8,10-11H2,1-3H3",COC(=O)C12CC3CC(C(C)O)C1N(CCC21Nc2ccc(OC)cc2C1=O)C3,C22H28N2O5,,400.199821996,QTZPBQMTXNEKRX,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Tabernaemontana hystrix,836904.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Tabernaemontaneae'],['Tabernaemontana'],['Tabernaemontana hystrix'],4,0,6.743443727493286 2078,5819,-1,,,,0.68586093,ISDB,QTZPBQMTXNEKRX-UHFFFAOYSA-N,"InChI=1S/C22H28N2O5/c1-12(25)15-8-13-10-21(20(27)29-3)18(15)24(11-13)7-6-22(21)19(26)16-9-14(28-2)4-5-17(16)23-22/h4-5,9,12-13,15,18,23,25H,6-8,10-11H2,1-3H3",COC(=O)C12CC3CC(C(C)O)C1N(CCC21Nc2ccc(OC)cc2C1=O)C3,C22H28N2O5,,400.199821996,QTZPBQMTXNEKRX,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Tabernaemontana apoda,6067990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Tabernaemontaneae'],['Tabernaemontana'],['Tabernaemontana apoda'],4,0,6.743443727493286 2079,5818,-1,,,,0.5897015,ISDB,UKIOTQZYKUPESG-JEOXALJRSA-N,"InChI=1S/C20H19NO4/c1-11-13-2-3-16-20(25-10-22-16)15(13)8-21-5-4-12-6-17-18(24-9-23-17)7-14(12)19(11)21/h2-3,6-7,11,19H,4-5,8-10H2,1H3/t11-,19+/m0/s1",C[C@H]1c2ccc3c(c2CN2CCc4cc5c(cc4[C@@H]12)OCO5)OCO3,C20H19NO4,,337.13140808799994,UKIOTQZYKUPESG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis remota,5727913.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis remota'],4,0,6.358805894851685 2080,5818,-1,,,,0.5897015,ISDB,UKIOTQZYKUPESG-WYRIXSBYSA-N,"InChI=1S/C20H19NO4/c1-11-13-2-3-16-20(25-10-22-16)15(13)8-21-5-4-12-6-17-18(24-9-23-17)7-14(12)19(11)21/h2-3,6-7,11,19H,4-5,8-10H2,1H3/t11-,19+/m1/s1",C[C@@H]1c2ccc3c(c2CN2CCc4cc5c(cc4[C@H]12)OCO5)OCO3,C20H19NO4,,337.131408088,UKIOTQZYKUPESG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis cava,5715966.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis cava'],4,0,6.358805894851685 2081,5818,-1,,,,0.5897015,ISDB,UKIOTQZYKUPESG-WLRWDXFRSA-N,"InChI=1S/C20H19NO4/c1-11-13-2-3-16-20(25-10-22-16)15(13)8-21-5-4-12-6-17-18(24-9-23-17)7-14(12)19(11)21/h2-3,6-7,11,19H,4-5,8-10H2,1H3/t11-,19-/m0/s1",C[C@H]1c2ccc3c(c2CN2CCc4cc5c(cc4[C@H]12)OCO5)OCO3,C20H19NO4,,337.131408088,UKIOTQZYKUPESG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Ceratocapnos heterocarpa,538846.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Ceratocapnos'],['Ceratocapnos heterocarpa'],4,0,6.358805894851685 2082,5818,-1,,,,0.5897015,ISDB,UKIOTQZYKUPESG-WLRWDXFRSA-N,"InChI=1S/C20H19NO4/c1-11-13-2-3-16-20(25-10-22-16)15(13)8-21-5-4-12-6-17-18(24-9-23-17)7-14(12)19(11)21/h2-3,6-7,11,19H,4-5,8-10H2,1H3/t11-,19-/m0/s1",C[C@H]1c2ccc3c(c2CN2CCc4cc5c(cc4[C@H]12)OCO5)OCO3,C20H19NO4,,337.131408088,UKIOTQZYKUPESG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis heterocarpa,5727953.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis heterocarpa'],4,0,6.358805894851685 2083,5816,-1,,,,0.0,MS1_match,NGYDXZFNGHZVIS-SKMYYDQESA-N,"InChI=1S/C24H34O10/c1-12(2)7-19(27)34-23-20-17(8-18(32-14(5)25)24(20)11-31-24)16(10-30-23)9-29-22(28)21(13(3)4)33-15(6)26/h10,12-13,17-18,20-21,23H,7-9,11H2,1-6H3/t17-,18+,20-,21-,23+,24-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)[C@H](OC(C)=O)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C24H34O10,pos_1_1proton1acetonitrile,482.215197288,NGYDXZFNGHZVIS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,0,6.0 2084,5816,-1,,,,0.0,MS1_match,UPWQTFMGRAGKCN-GMHONNGPSA-N,"InChI=1S/C24H34O10/c1-13(2)7-20(27)33-19-9-18-17(10-30-15(5)25)11-31-23(34-21(28)8-14(3)4)22(18)24(19,29)12-32-16(6)26/h9,11,13-14,19,22-23,29H,7-8,10,12H2,1-6H3/t19-,22+,23-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(C)=O,C24H34O10,pos_1_1proton1acetonitrile,482.21519728799984,UPWQTFMGRAGKCN,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2085,5816,-1,,,,0.0,MS1_match,UPWQTFMGRAGKCN-GMHONNGPSA-N,"InChI=1S/C24H34O10/c1-13(2)7-20(27)33-19-9-18-17(10-30-15(5)25)11-31-23(34-21(28)8-14(3)4)22(18)24(19,29)12-32-16(6)26/h9,11,13-14,19,22-23,29H,7-8,10,12H2,1-6H3/t19-,22+,23-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(C)=O,C24H34O10,pos_1_1proton1acetonitrile,482.21519728799984,UPWQTFMGRAGKCN,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana alliariifolia,5746411.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana alliariifolia'],6,0,6.0 2086,5816,-1,,,,0.0,MS1_match,JCQNBCPVSOEFPG-GMHONNGPSA-N,"InChI=1S/C24H34O10/c1-13(2)7-20(27)30-10-17-11-31-23(34-21(28)8-14(3)4)22-18(17)9-19(33-16(6)26)24(22,29)12-32-15(5)25/h9,11,13-14,19,22-23,29H,7-8,10,12H2,1-6H3/t19-,22+,23-,24+/m0/s1",CC(=O)OC[C@@]1(O)[C@@H](OC(C)=O)C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]21,C24H34O10,pos_1_1proton1acetonitrile,482.215197288,JCQNBCPVSOEFPG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 2087,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Heliotropium lasiocarpum,805469.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Heliotropiaceae'],['Unknown'],['Heliotropium'],['Heliotropium lasiocarpum'],4,0,6.543015241622925 2088,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Rostrinucula dependens,284543.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Pogostemoneae'],['Rostrinucula'],['Rostrinucula dependens'],4,0,6.543015241622925 2089,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Cinnamomum parthenoxylon,129758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Cinnamomum'],['Cinnamomum parthenoxylon'],4,0,6.543015241622925 2090,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Piper chaba,505281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper retrofractum'],4,0,6.543015241622925 2091,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Piper retrofractum,505281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper retrofractum'],4,0,6.543015241622925 2092,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Piper philippinum,290828.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper nudibaccatum'],4,0,6.543015241622925 2093,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Piper kwashoense,6030948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper kwashoense'],4,0,6.543015241622925 2094,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Achillea grandifolia,245232.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Achillea'],['Achillea grandifolia'],4,0,6.543015241622925 2095,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Mangifera indica,807634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Mangifera'],['Mangifera indica'],4,0,6.543015241622925 2096,5815,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6357538,ISDB,SATCULPHIDQDRE-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2",O=Cc1ccc2c(c1)OCO2,C8H6O3,,150.031694052,SATCULPHIDQDRE,Shikimates and Phenylpropanoids,,,Piper nigrum,472526.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper nigrum'],4,0,6.543015241622925 2097,5814,-1,,,,0.0,MS1_match,JLMFDWPNHVELBS-SKYCUDPYSA-N,"InChI=1S/C31H41NO8/c1-32-14-29(15-36-2)12-11-18(37-3)31-17-13-30(35)26(40-28(34)16-9-7-6-8-10-16)19(17)20(22(33)27(30)39-5)21(25(31)32)23(38-4)24(29)31/h6-10,17-21,23-27,35H,11-15H2,1-5H3/t17-,18+,19+,20+,21?,23+,24-,25?,26-,27-,29+,30-,31?/m1/s1",COC[C@@]12CC[C@H](OC)C34C(C([C@H]5C(=O)[C@@H](OC)[C@@]6(O)C[C@@H]3[C@@H]5[C@H]6OC(=O)c3ccccc3)[C@H](OC)[C@@H]41)N(C)C2,C31H41NO8,pos_2_2proton1ammonium,555.283217272,JLMFDWPNHVELBS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 2098,5814,-1,,,,0.0,MS1_match,PPFAXCLJDSSALI-WPBQINKFSA-N,"InChI=1S/C31H41NO8/c1-5-32-15-29(16-36-2)12-11-21(37-3)31-19-14-30(35)25(40-27(34)17-9-7-6-8-10-17)22(19)18(23(33)26(30)38-4)13-20(24(29)31)39-28(31)32/h6-10,13,19-26,28,33,35H,5,11-12,14-16H2,1-4H3/t19-,20+,21+,22-,23-,24-,25-,26+,28-,29+,30-,31+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5C(=C[C@H](O[C@@H]13)[C@H]24)[C@@H](O)[C@@H]6OC,C31H41NO8,pos_2_2proton1ammonium,555.283217272,PPFAXCLJDSSALI,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 2099,5814,-1,,,,0.0,MS1_match,DXECHRXVEUPWCB-ANUSZKSFSA-N,"InChI=1S/C31H44N2O8/c1-5-33-14-28(15-41-26(35)16-8-6-7-9-19(16)32)11-10-21(39-3)30-18-12-17-20(38-2)13-29(36,22(18)23(17)34)31(37,27(30)33)25(40-4)24(28)30/h6-9,17-18,20-25,27,34,36-37H,5,10-15,32H2,1-4H3/t17-,18-,20+,21-,22-,23+,24-,25+,27+,28+,29-,30+,31-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C31H44N2O8,pos_2_2proton,572.309766368,DXECHRXVEUPWCB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium dictyocarpum,6131639.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium dictyocarpum'],6,0,6.0 2100,5812,-1,,,,0.0,MS1_match,PGYAYSRVSAJXTE-CLONMANBSA-N,"InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35-36(5,6)25-33(41)27-38(35,9)43)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-21,23-24,33-34,41-43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t22?,33-,34-,38+,39+,40-/m0/s1",C/C(C=C=C1C(C)(C)C[C@H](O)C[C@@]1(C)O)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C,C40H56O4,pos_1_sodium,600.417860272,PGYAYSRVSAJXTE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Trollius europaeus,805006.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius europaeus'],6,0,6.0 2101,5812,-1,,,,0.0,MS1_match,ZVKXPPXCNUMUOR-WYZRDEAWSA-N,"InChI=1S/C40H56O4/c1-28(17-13-18-30(3)21-22-35-37(5,6)24-32(41)26-39(35,9)43)15-11-12-16-29(2)19-14-20-31(4)34-23-36-38(7,8)25-33(42)27-40(36,10)44-34/h11-21,23,32-34,41-43H,24-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20-/t22?,32-,33-,34?,39+,40+/m0/s1",C/C(=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=C=C1C(C)(C)C[C@H](O)C[C@@]1(C)O)C1C=C2C(C)(C)C[C@H](O)C[C@@]2(C)O1,C40H56O4,pos_1_sodium,600.417860272,ZVKXPPXCNUMUOR,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Ranunculus acris,387818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus acris'],6,0,6.0 2102,5812,-1,,,,0.0,MS1_match,IPEHJNRNYPOFII-UHFFFAOYSA-N,"InChI=1S/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-10,12,18,21H,6-8,11H2,1-5H3",CC(C)c1cc2c(cc1O)C1(C)CCCC(C)(C)C1CC2=O,C20H28O2,pos_2MNa,300.208930136,IPEHJNRNYPOFII,Terpenoids,Diterpenoids,Abietane diterpenoids,Delphinium cyphoplectrum,309504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cyphoplectrum'],6,0,6.0 2103,5811,-1,,,,0.0,MS1_match,GJOKUHOJKKOIEW-UHFFFAOYSA-N,"InChI=1S/C12H14O6/c1-7(4-13)12(17)3-11(18-8(2)16)9(5-14)10(12)6-15/h4,6,11,14,17H,1,3,5H2,2H3",C=C(C=O)C1(O)CC(OC(C)=O)C(CO)=C1C=O,C12H14O6,pos_1_1proton,254.079038168,GJOKUHOJKKOIEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2104,5810,-1,,,,0.0,MS1_match,CTRWBXOZUNMXCL-UHFFFAOYSA-N,"InChI=1S/C35H38O11/c1-21(36)42-20-34-25(44-26(38)17-16-23-12-8-6-9-13-23)18-19-33(5,41)35(34)29(43-22(2)37)27(32(3,4)46-35)28(39)30(34)45-31(40)24-14-10-7-11-15-24/h6-17,25,27,29-30,41H,18-20H2,1-5H3",CC(=O)OCC12C(OC(=O)C=Cc3ccccc3)CCC(C)(O)C13OC(C)(C)C(C(=O)C2OC(=O)c1ccccc1)C3OC(C)=O,C35H38O11,pos_1_1proton1methanol,634.241412036,CTRWBXOZUNMXCL,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 2105,5810,-1,,,,0.0,MS1_match,CTRWBXOZUNMXCL-UHFFFAOYSA-N,"InChI=1S/C35H38O11/c1-21(36)42-20-34-25(44-26(38)17-16-23-12-8-6-9-13-23)18-19-33(5,41)35(34)29(43-22(2)37)27(32(3,4)46-35)28(39)30(34)45-31(40)24-14-10-7-11-15-24/h6-17,25,27,29-30,41H,18-20H2,1-5H3",CC(=O)OCC12C(OC(=O)C=Cc3ccccc3)CCC(C)(O)C13OC(C)(C)C(C(=O)C2OC(=O)c1ccccc1)C3OC(C)=O,C35H38O11,pos_1_1proton1methanol,634.241412036,CTRWBXOZUNMXCL,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 2106,5809,-1,,,,0.65825427,ISDB,PJRADUSKEHIPDZ-PHHSCZKOSA-N,"InChI=1S/C30H38O5/c1-16-9-7-11-20-13-29(21(14-26(16,20)5)18(3)23(31)33-29)30-22(19(4)24(32)34-30)15-27(6)17(2)10-8-12-28(27)25(30)35-28/h13,16-17,25H,7-12,14-15H2,1-6H3/t16-,17-,25+,26+,27+,28-,29-,30+/m1/s1",CC1=C2C[C@]3(C)C(=C[C@@]2([C@]24OC(=O)C(C)=C2C[C@@]2(C)[C@H](C)CCC[C@]25O[C@@H]54)OC1=O)CCC[C@H]3C,C30H38O5,,478.271924316,PJRADUSKEHIPDZ,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Ligularia fischeri,619951.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia fischeri'],4,0,6.633017063140869 2107,5805,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,VJVAGEFZPPWVPV-QACLQDTKSA-N,"InChI=1S/C36H40N2O6/c1-37-13-11-23-18-32(41-3)33-19-26(23)28(37)16-22-7-10-30(39)31(17-22)43-24-8-5-21(6-9-24)15-29-27-20-34(42-4)35(40)36(44-33)25(27)12-14-38(29)2/h5-10,17-20,23,26,28-29,39-40H,11-16H2,1-4H3/t23-,26-,28-,29-/m0/s1",COC1=C[C@@H]2CCN(C)[C@H]3Cc4ccc(O)c(c4)Oc4ccc(cc4)C[C@H]4c5cc(OC)c(O)c(c5CCN4C)OC1=C[C@@H]23,C36H40N2O6,pos_1_sodium,596.288637,VJVAGEFZPPWVPV,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 2108,5802,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.70533985,ISDB,YAMUFBLWGFFICM-PTGWMXDISA-N,"InChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/b13-12-/t25-/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H52NO7P,,521.348139634,YAMUFBLWGFFICM,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,3,5.321359395980835 2109,5801,1801,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,0.2725679,ISDB,IOUQUFVYKJOHBO-SYUMXFIHSA-N,"InChI=1S/C25H37NO3S/c1-16-8-6-9-21-24(16,3)11-10-17(2)25(21,4)15-18-22(28)19(14-20(27)23(18)29)26-12-7-13-30-5/h8,14,17,21,26,29H,6-7,9-13,15H2,1-5H3/t17-,21+,24-,25+/m0/s1",CSCCCNC1=CC(=O)C(O)=C(C[C@]2(C)[C@@H](C)CC[C@@]3(C)C(C)=CCC[C@@H]23)C1=O,C25H37NO3S,,431.2494150440001,IOUQUFVYKJOHBO,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Dactylospongia metachromia,533033.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Dictyoceratida'],['Thorectidae'],['Unknown'],['Dactylospongia'],['Dactylospongia metachromia'],1,3,3.5902715921401978 2110,5798,110,Fatty acids,Octadecanoids,Other Octadecanoids,0.7659935,ISDB,ACHDMUPTZYZIGR-CUHSZNQNSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3-,8-6-,14-11+",CC/C=C\C/C=C\C=C\C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Isatis tinctoria,631500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Isatideae'],['Isatis'],['Isatis tinctoria'],4,3,8.563973903656006 2111,5798,110,Fatty acids,Octadecanoids,Other Octadecanoids,0.7659935,ISDB,ACHDMUPTZYZIGR-JPAZTHTMSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3+,8-6+,14-11+",CC/C=C/C/C=C/C=C/C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,8.563973903656006 2112,5795,-1,,,,0.0,MS1_match,VHUNCYDAXJGCLO-YAAMDAGVSA-N,"InChI=1S/C19H26O12/c1-27-17(26)8-4-2-3-5-10(8)30-19-16(25)14(23)13(22)11(31-19)7-29-18-15(24)12(21)9(20)6-28-18/h2-5,9,11-16,18-25H,6-7H2,1H3/t9-,11+,12-,13+,14-,15+,16+,18-,19+/m0/s1",COC(=O)c1ccccc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C19H26O12,pos_1_1proton1acetonitrile,446.1424262719998,VHUNCYDAXJGCLO,,,,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 2113,5795,-1,,,,0.0,MS1_match,VHUNCYDAXJGCLO-YAAMDAGVSA-N,"InChI=1S/C19H26O12/c1-27-17(26)8-4-2-3-5-10(8)30-19-16(25)14(23)13(22)11(31-19)7-29-18-15(24)12(21)9(20)6-28-18/h2-5,9,11-16,18-25H,6-7H2,1H3/t9-,11+,12-,13+,14-,15+,16+,18-,19+/m0/s1",COC(=O)c1ccccc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C19H26O12,pos_1_1proton1acetonitrile,446.1424262719998,VHUNCYDAXJGCLO,,,,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 2114,5794,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_2MH,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 2115,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 2116,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 2117,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 2118,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-YAEAOFIFSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ambiguum,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2119,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 2120,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 2121,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 2122,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2123,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-YAEAOFIFSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 2124,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2125,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 2126,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2127,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2128,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-JOPURWDVSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20-,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 2129,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,0,6.0 2130,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-YAEAOFIFSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2131,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-WIRSCEAYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium carolinianum,529153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carolinianum'],6,0,6.0 2132,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2133,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 2134,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2135,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-JOPURWDVSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20-,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 2136,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,0,6.0 2137,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2138,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 2139,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2140,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium biternatum,884042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium biternatum'],6,0,6.0 2141,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum georgei,1061369.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum georgei'],6,0,6.0 2142,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum franchetii,1088654.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum franchetii'],6,0,6.0 2143,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum monticola,625485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum monticola'],6,0,6.0 2144,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,0,6.0 2145,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum leucostomum,723178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum leucostomum'],6,0,6.0 2146,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium uralense,6131833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium uralense'],6,0,6.0 2147,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 2148,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum longtouense,488241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum longtouense'],6,0,6.0 2149,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,0,6.0 2150,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,0,6.0 2151,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium umbrosum,5737858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium umbrosum'],6,0,6.0 2152,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium menziesii,643534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium menziesii'],6,0,6.0 2153,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 2154,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium leroyi,259373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium leroyi'],6,0,6.0 2155,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 2156,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 2157,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2158,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 2159,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 2160,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2161,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 2162,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 2163,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-WIRSCEAYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium carolinianum,529153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carolinianum'],6,0,6.0 2164,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,0,6.0 2165,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,0,6.0 2166,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2167,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 2168,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium brunonianum,259375.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium minjanense'],6,0,6.0 2169,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 2170,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-QLPMSXOHSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18-,19-,20-,21+,22+,23-,24+,25-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](OC)[C@@]34[C@@H]1[C@@](O)([C@@H](OC)[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 2171,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum delphiniifolium,506023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum delphiniifolium'],6,0,6.0 2172,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 2173,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-OGYQBBOKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19+,20+,21-,22+,23-,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H]13)[C@@H](OC)[C@@H]24,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium biternatum,884042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium biternatum'],6,0,6.0 2174,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2175,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucescens,70143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucescens'],6,0,6.0 2176,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium zalil,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2177,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbartum,3944980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbartum'],6,0,6.0 2178,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbatum,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2179,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium mollipilum,6131736.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium mollipilum'],6,0,6.0 2180,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 2181,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 2182,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium corymbosum,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2183,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium iliense,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2184,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium cyphoplectrum,309504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cyphoplectrum'],6,0,6.0 2185,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2186,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 2187,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2188,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-YAEAOFIFSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2189,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 2190,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2191,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium scabriflorum,6131796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium scabriflorum'],6,0,6.0 2192,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 2193,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 2194,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium menziesii,643534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium menziesii'],6,0,6.0 2195,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,0,6.0 2196,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium leroyi,259373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium leroyi'],6,0,6.0 2197,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2198,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2199,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 2200,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2201,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium orientale,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2202,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 2203,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 2204,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium carduchorum,884028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carduchorum'],6,0,6.0 2205,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-YVNSXEBHSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18-,19+,20+,21-,22-,23-,24-,25+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2[C@@H](OC)[C@@](O)([C@@H]13)[C@]1(OC)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 2206,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2207,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZHKWZOSWJFLWBA-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)33-5)25(29,21(24)26)20(27)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](O)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZHKWZOSWJFLWBA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sajanense,5737820.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sajanense'],6,0,6.0 2208,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZHKWZOSWJFLWBA-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)33-5)25(29,21(24)26)20(27)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](O)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZHKWZOSWJFLWBA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 2209,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,BWOVBUJCJDASBC-WPENWWETSA-N,"InChI=1S/C25H41NO7/c1-5-26-11-22(12-31-2)7-6-17(27)24-15-8-13-16(32-3)10-23(29,9-14(15)18(13)28)25(30,21(24)26)20(33-4)19(22)24/h13-21,27-30H,5-12H2,1-4H3/t13-,14-,15-,16+,17+,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5C[C@@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,BWOVBUJCJDASBC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium leroyi,259373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium leroyi'],6,0,6.0 2210,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ODGJERSCDQAVFS-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-5-8-26-11-22(12-27)7-6-16(32-3)24-14-9-13-15(31-2)10-23(29,17(14)18(13)28)25(30,21(24)26)20(33-4)19(22)24/h13-21,27-30H,5-12H2,1-4H3",CCCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ODGJERSCDQAVFS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 2211,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YWHBAYCZDOMFAJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-5-8-26-11-22(12-31-2)7-6-16(27)24-14-9-13-15(32-3)10-23(29,17(14)18(13)28)25(30,21(24)26)20(33-4)19(22)24/h13-21,27-30H,5-12H2,1-4H3",CCCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YWHBAYCZDOMFAJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 2212,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,PABNTGUVPKRNRM-KCOJYJFYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)32-4)25(29,21(24)26)20(28)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18-,19+,20+,21-,22-,23-,24-,25+/m0/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@@]34[C@@H]2[C@@H](O)[C@@](O)([C@@H]13)[C@]1(OC)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,PABNTGUVPKRNRM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2213,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,PABNTGUVPKRNRM-JOPURWDVSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)32-4)25(29,21(24)26)20(28)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20-,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,PABNTGUVPKRNRM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 2214,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,PABNTGUVPKRNRM-JOPURWDVSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)32-4)25(29,21(24)26)20(28)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20-,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,PABNTGUVPKRNRM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 2215,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,DQEABNIOXCZHOW-UNPHAQEPSA-N,"InChI=1S/C25H41NO7/c1-6-26-10-23(11-30-2)15(27)8-16(32-4)25-13-7-12-14(31-3)9-24(29,17(13)19(12)28)18(22(25)26)20(33-5)21(23)25/h12-22,27-29H,6-11H2,1-5H3/t12-,13-,14+,15-,16+,17-,18+,19+,20-,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,DQEABNIOXCZHOW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 2216,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,DQEABNIOXCZHOW-UNPHAQEPSA-N,"InChI=1S/C25H41NO7/c1-6-26-10-23(11-30-2)15(27)8-16(32-4)25-13-7-12-14(31-3)9-24(29,17(13)19(12)28)18(22(25)26)20(33-5)21(23)25/h12-22,27-29H,6-11H2,1-5H3/t12-,13-,14+,15-,16+,17-,18+,19+,20-,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,DQEABNIOXCZHOW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 2217,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,DQEABNIOXCZHOW-UNPHAQEPSA-N,"InChI=1S/C25H41NO7/c1-6-26-10-23(11-30-2)15(27)8-16(32-4)25-13-7-12-14(31-3)9-24(29,17(13)19(12)28)18(22(25)26)20(33-5)21(23)25/h12-22,27-29H,6-11H2,1-5H3/t12-,13-,14+,15-,16+,17-,18+,19+,20-,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,DQEABNIOXCZHOW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 2218,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 2219,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2220,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium orientale,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2221,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 2222,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2223,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium umbrosum,5737858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium umbrosum'],6,0,6.0 2224,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-YVNSXEBHSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18-,19+,20+,21-,22-,23-,24-,25+/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2[C@@H](OC)[C@@](O)([C@@H]13)[C@]1(OC)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 2225,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,0,6.0 2226,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum leucostomum,723178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum leucostomum'],6,0,6.0 2227,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium uralense,6131833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium uralense'],6,0,6.0 2228,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 2229,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 2230,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium biternatum,884042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium biternatum'],6,0,6.0 2231,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2232,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,0,6.0 2233,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2234,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 2235,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-YAEAOFIFSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ambiguum,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2236,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 2237,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 2238,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 2239,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-YAEAOFIFSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 2240,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 2241,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-QSWCHXNUSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15-,16-,17+,18-,19-,20-,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](O)[C@]34C1[C@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@@H]4[C@H]1[C@@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum monticola,625485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum monticola'],6,0,6.0 2242,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum franchetii,1088654.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum franchetii'],6,0,6.0 2243,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum longtouense,488241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum longtouense'],6,0,6.0 2244,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 2245,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2246,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium scabriflorum,6131796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium scabriflorum'],6,0,6.0 2247,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 2248,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 2249,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium menziesii,643534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium menziesii'],6,0,6.0 2250,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium leroyi,259373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium leroyi'],6,0,6.0 2251,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 2252,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2253,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-QNITWFEASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)C(O)([C@@H]13)[C@@H](OC)[C@H]24,C25H41NO7,pos_1_1proton1ammonium,467.288302652,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2254,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,PJAKSXLGPWJDTL-BVVKAGQZSA-N,"InChI=1S/C25H41NO7/c1-7-26-12-21(2)9-8-15(31-4)24-18(21)19(33-6)25(29,20(24)26)23(28)11-14(30-3)13-10-22(24,27)17(23)16(13)32-5/h13-20,27-29H,7-12H2,1-6H3/t13-,14+,15+,16+,17+,18-,19+,20+,21+,22+,23-,24-,25+/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,PJAKSXLGPWJDTL,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ternatum,6131820.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium ternatum'],6,0,6.0 2255,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2256,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 2257,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2258,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,JVBLTQQBEQQLEV-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,JVBLTQQBEQQLEV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum georgei,1061369.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum georgei'],6,0,6.0 2259,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,ZUMVRGDGUZROMJ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(33-5,17(14)18(13)28)25(29,21(24)26)20(32-4)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(OC)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,ZUMVRGDGUZROMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium carduchorum,884028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carduchorum'],6,0,6.0 2260,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-QLPMSXOHSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18-,19-,20-,21+,22+,23-,24+,25-/m0/s1",CCN1C[C@@]2(COC)CC[C@H](OC)[C@@]34[C@@H]1[C@@](O)([C@@H](OC)[C@@H]23)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 2261,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum delphiniifolium,506023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum delphiniifolium'],6,0,6.0 2262,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 2263,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2264,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 2265,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium umbrosum,5737858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium umbrosum'],6,0,6.0 2266,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum brachypodum,50012.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum brachypodum'],6,0,6.0 2267,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 2268,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 2269,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-WIRSCEAYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 2270,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum finetianum,556431.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum finetianum'],6,0,6.0 2271,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium scabriflorum,6131796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium scabriflorum'],6,0,6.0 2272,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2273,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,0,6.0 2274,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2275,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,0,6.0 2276,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium delavayi,70138.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium delavayi'],6,0,6.0 2277,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nudicaule,643530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nudicaule'],6,0,6.0 2278,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium fissum,833960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium fissum'],6,0,6.0 2279,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium schmalhausenii,7591251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium schmalhausenii'],6,0,6.0 2280,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,0,6.0 2281,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 2282,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 2283,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium dictyocarpum,6131639.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium dictyocarpum'],6,0,6.0 2284,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2285,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2286,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2287,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium orientale,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2288,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-WIXPRNEISA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14+,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stenocarpum,784182.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella stenocarpa'],6,0,6.0 2289,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 2290,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium armeniacum,643530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nudicaule'],6,0,6.0 2291,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-WQDZHITMSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22-,23-,24+,25+/m1/s1",CCN1C[C@@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 2292,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 2293,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 2294,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium cashmerianum,884026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cashmerianum'],6,0,6.0 2295,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 2296,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium retropilosum,5737876.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium retropilosum'],6,0,6.0 2297,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium albiflorum,6131751.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium albiflorum'],6,0,6.0 2298,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucescens,70143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucescens'],6,0,6.0 2299,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbatum,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2300,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 2301,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 2302,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium albiflorum,6131751.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium albiflorum'],6,0,6.0 2303,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 2304,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 2305,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium dictyocarpum,6131639.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium dictyocarpum'],6,0,6.0 2306,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nordhagenii,5737855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nordhagenii'],6,0,6.0 2307,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2308,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2309,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium orientale,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2310,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-WIXPRNEISA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14+,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@H]4[C@@H]1[C@H]2OC,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stenocarpum,784182.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella stenocarpa'],6,0,6.0 2311,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 2312,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium armeniacum,643530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nudicaule'],6,0,6.0 2313,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-WQDZHITMSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22-,23-,24+,25+/m1/s1",CCN1C[C@@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 2314,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2315,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium thamarae,6131823.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium thamarae'],6,0,6.0 2316,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium caeruleum,884038.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium caeruleum'],6,0,6.0 2317,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 2318,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbartum,3944980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbartum'],6,0,6.0 2319,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 2320,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,0,6.0 2321,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium corymbosum,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2322,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium iliense,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2323,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 2324,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,0,6.0 2325,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 2326,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 2327,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium brunonianum,259375.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium minjanense'],6,0,6.0 2328,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,0,6.0 2329,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2330,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ambiguum,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2331,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 2332,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2333,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium zalil,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2334,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YPJNTJHXPKFINJ-QRMYGITRSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)16(27)7-8-23-14-9-13-15(31-3)10-24(28,17(14)18(13)32-4)25(29,21(23)26)20(33-5)19(22)23/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+,21+,22+,23-,24-,25-/m1/s1",CCN1C[C@]2(COC)[C@H](O)CC[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YPJNTJHXPKFINJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium biternatum,884042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium biternatum'],6,0,6.0 2335,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 2336,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nordhagenii,5737855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nordhagenii'],6,0,6.0 2337,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 2338,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 2339,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 2340,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 2341,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2342,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2343,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium leroyi,259373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium leroyi'],6,0,6.0 2344,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 2345,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 2346,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium cashmerianum,884026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cashmerianum'],6,0,6.0 2347,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 2348,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,0,6.0 2349,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium schmalhausenii,7591251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium schmalhausenii'],6,0,6.0 2350,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium fissum,833960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium fissum'],6,0,6.0 2351,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 2352,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 2353,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium menziesii,643534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium menziesii'],6,0,6.0 2354,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 2355,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-OGYQBBOKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19+,20+,21-,22+,23-,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H]13)[C@@H](OC)[C@@H]24,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium biternatum,884042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium biternatum'],6,0,6.0 2356,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2357,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucescens,70143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucescens'],6,0,6.0 2358,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium zalil,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2359,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbartum,3944980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbartum'],6,0,6.0 2360,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbatum,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2361,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium mollipilum,6131736.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium mollipilum'],6,0,6.0 2362,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 2363,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 2364,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium corymbosum,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2365,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium iliense,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2366,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium cyphoplectrum,309504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cyphoplectrum'],6,0,6.0 2367,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 2368,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium brunonianum,259375.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium minjanense'],6,0,6.0 2369,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,MODXUQZMEBLSJD-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)27)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,MODXUQZMEBLSJD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 2370,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-WIRSCEAYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 2371,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 2372,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2373,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium umbrosum,5737858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium umbrosum'],6,0,6.0 2374,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium iliense,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2375,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 2376,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,0,6.0 2377,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 2378,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 2379,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium brunonianum,259375.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium minjanense'],6,0,6.0 2380,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium corymbosum,5737883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium iliense'],6,0,6.0 2381,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,0,6.0 2382,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ambiguum,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2383,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 2384,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 2385,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 2386,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium caeruleum,884038.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium caeruleum'],6,0,6.0 2387,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-URABJAIZSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18?,19?,20?,21?,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium thamarae,6131823.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium thamarae'],6,0,6.0 2388,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2389,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,0,6.0 2390,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 2391,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbartum,3944980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbartum'],6,0,6.0 2392,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum brachypodum,50012.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum brachypodum'],6,0,6.0 2393,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 2394,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 2395,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-UHFFFAOYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3",CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum finetianum,556431.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum finetianum'],6,0,6.0 2396,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nudicaule,643530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nudicaule'],6,0,6.0 2397,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium scabriflorum,6131796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium scabriflorum'],6,0,6.0 2398,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tatsienense,176347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tatsienense'],6,0,6.0 2399,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,0,6.0 2400,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 2401,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,0,6.0 2402,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium delavayi,70138.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium delavayi'],6,0,6.0 2403,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-DIZROUMASA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium retropilosum,5737876.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium retropilosum'],6,0,6.0 2404,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucescens,70143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucescens'],6,0,6.0 2405,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium zalil,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2406,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbatum,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 2407,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YOTUXHIWBVZAJQ-VCDUNCIKSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.288302652,YOTUXHIWBVZAJQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 2408,5792,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,AKYZMAZEPZKCAR-WIRSCEAYSA-N,"InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(31-3)24-14-9-13-15(27)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6O)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO7,pos_1_1proton1ammonium,467.2883026519999,AKYZMAZEPZKCAR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium biternatum,884042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium biternatum'],6,0,6.0 2409,5788,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,NKFZLEYLWAFYEH-NSSLBSGISA-N,"InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15+,17-,18-,20-,21+,24+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,pos_1_sodium,596.1377348159999,NKFZLEYLWAFYEH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,7.5 2410,5788,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,NKFZLEYLWAFYEH-NSSLBSGISA-N,"InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15+,17-,18-,20-,21+,24+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,pos_1_sodium,596.1377348159999,NKFZLEYLWAFYEH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,3,7.5 2411,5786,1773,Terpenoids,Apocarotenoids,Cinnamic acids and derivatives,0.46421155,ISDB,QIOYKXMTBUDZHZ-SECBINFHSA-N,"InChI=1S/C11H18O3/c1-7-8(4-5-12)11(2,3)6-9(13)10(7)14/h9,12-13H,4-6H2,1-3H3/t9-/m1/s1",CC1=C(CCO)C(C)(C)C[C@@H](O)C1=O,C11H18O3,,198.125594436,QIOYKXMTBUDZHZ,Terpenoids,Apocarotenoids,Megastigmanes,Robinia pseudoacacia,928416.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Robinieae'],['Robinia'],['Robinia pseudoacacia'],4,2,6.856846213340759 2412,5785,-1,,,,0.41331822,ISDB,UHMOZKAOIWBLIZ-RYDMNKFPSA-N,"InChI=1S/C28H44O4/c1-16-6-11-27-13-12-26(5)25(4)10-7-18-14-19(29)8-9-24(18,3)20(25)15-21(30)28(26,32-23(27)31)22(27)17(16)2/h16-22,29-30H,6-15H2,1-5H3/t16-,17+,18+,19+,20-,21-,22-,24+,25-,26+,27+,28+/m1/s1",C[C@H]1[C@H](C)CC[C@@]23CC[C@]4(C)[C@](OC2=O)([C@H](O)C[C@@H]2[C@@]5(C)CC[C@H](O)C[C@@H]5CC[C@]24C)[C@H]13,C28H44O4,,444.323959888,UHMOZKAOIWBLIZ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Vaccinium myrtillus,817730.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Vaccinieae'],['Vaccinium'],['Vaccinium myrtillus'],4,0,5.653272867202759 2413,5784,-1,,,,0.0,MS1_match,TUOQDKWZMVPMKF-FWBAFIGCSA-N,"InChI=1S/C32H34O12/c1-17-12-23(41-27(34)19-6-9-37-14-19)26(40-18(2)33)31(5)24(42-28(35)20-7-10-38-15-20)13-22-25(32(17,31)44-30(22,3)4)43-29(36)21-8-11-39-16-21/h6-11,14-17,22-26H,12-13H2,1-5H3/t17-,22-,23+,24+,25-,26+,31-,32-/m1/s1",CC(=O)O[C@H]1[C@@H](OC(=O)c2ccoc2)C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccoc4)[C@]12C)[C@H]3OC(=O)c1ccoc1,C32H34O12,pos_1_1proton1methanol,610.2050265279998,TUOQDKWZMVPMKF,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,6.0 2414,5783,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OCBGWPJNUZMLCA-RDJZCZTQSA-N,"InChI=1S/C20H18O8/c1-24-13-7-10(3-5-12(13)22)17-15(9-21)26-20-18-11(4-6-16(23)27-18)8-14(25-2)19(20)28-17/h3-8,15,17,21-22H,9H2,1-2H3/t15-,17-/m0/s1",COc1cc([C@@H]2Oc3c(OC)cc4ccc(=O)oc4c3O[C@H]2CO)ccc1O,C20H18O8,pos_1_minus1proton2potassium,386.100167536,OCBGWPJNUZMLCA,Shikimates and Phenylpropanoids,Coumarins,Coumarinolignans,Coptis japonica,387829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis japonica'],6,1,6.5 2415,5783,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OCBGWPJNUZMLCA-RDJZCZTQSA-N,"InChI=1S/C20H18O8/c1-24-13-7-10(3-5-12(13)22)17-15(9-21)26-20-18-11(4-6-16(23)27-18)8-14(25-2)19(20)28-17/h3-8,15,17,21-22H,9H2,1-2H3/t15-,17-/m0/s1",COc1cc([C@@H]2Oc3c(OC)cc4ccc(=O)oc4c3O[C@H]2CO)ccc1O,C20H18O8,pos_1_minus1proton2potassium,386.100167536,OCBGWPJNUZMLCA,Shikimates and Phenylpropanoids,Coumarins,Coumarinolignans,Coptis japonica,387829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis japonica'],6,1,6.5 2416,5778,-1,,,,0.0,MS1_match,LLTOPKQGFAAMKH-UHFFFAOYSA-N,"InChI=1S/C12H12O4/c1-7-4-8(14-2)5-10-12(7)9(15-3)6-11(13)16-10/h4-6H,1-3H3",COc1cc(C)c2c(OC)cc(=O)oc2c1,C12H12O4,pos_2_2proton2acetonitrile,220.073558864,LLTOPKQGFAAMKH,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 2417,5776,804,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),0.0,MS1_match,HNZUNIKWNYHEJJ-FMIVXFBMSA-N,"InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+",CC(=O)CC/C=C(\C)CCC=C(C)C,C13H22O,pos_1_1proton,194.167065324,HNZUNIKWNYHEJJ,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2418,5775,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.3074937,ISDB,NJXYDZDDOCQODQ-FCAPPQLESA-N,"InChI=1S/C40H77NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,32-38,40,42-47H,3-18,21-31H2,1-2H3,(H,41,48)/b20-19-/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1",CCCCCCCCC/C=C\CCCC[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCC,C40H77NO9,,715.559833044,NJXYDZDDOCQODQ,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,3,6.729974746704102 2419,5775,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.3074937,ISDB,NJXYDZDDOCQODQ-WSEQXECZSA-N,"InChI=1S/C40H77NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,32-38,40,42-47H,3-18,21-31H2,1-2H3,(H,41,48)/b20-19+/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1",CCCCCCCCC/C=C/CCCC[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCC,C40H77NO9,,715.559833044,NJXYDZDDOCQODQ,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Rhaponticum chinense,27810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Klaseopsis'],['Klaseopsis chinensis'],4,3,6.729974746704102 2420,5775,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.3074937,ISDB,NJXYDZDDOCQODQ-WSEQXECZSA-N,"InChI=1S/C40H77NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,32-38,40,42-47H,3-18,21-31H2,1-2H3,(H,41,48)/b20-19+/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1",CCCCCCCCC/C=C/CCCC[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCC,C40H77NO9,,715.559833044,NJXYDZDDOCQODQ,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Sagina japonica,161892.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Sagineae'],['Sagina'],['Sagina japonica'],4,3,6.729974746704102 2421,5774,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.36269358,ISDB,WBWMANUPDBBHGO-YYWYGQEZSA-N,"InChI=1S/C18H37NO5/c20-12-8-10-14(22)9-6-4-2-1-3-5-7-11-15-17(23)18(24)16(13-21)19-15/h14-24H,1-13H2/t14-,15+,16+,17+,18+/m0/s1",OCCC[C@@H](O)CCCCCCCCC[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O,C18H37NO5,,347.267173284,WBWMANUPDBBHGO,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Broussonetia kazinoki,734176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Broussonetia'],['Broussonetia kazinoki'],4,0,5.450774312019348 2422,5774,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.36269358,ISDB,WBWMANUPDBBHGO-UHFFFAOYSA-N,"InChI=1S/C18H37NO5/c20-12-8-10-14(22)9-6-4-2-1-3-5-7-11-15-17(23)18(24)16(13-21)19-15/h14-24H,1-13H2",OCCCC(O)CCCCCCCCCC1NC(CO)C(O)C1O,C18H37NO5,,347.267173284,WBWMANUPDBBHGO,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Broussonetia papyrifera,311274.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Broussonetia'],['Broussonetia papyrifera'],4,0,5.450774312019348 2423,5771,-1,,,,0.0,MS1_match,CNYNNXTXLZLYLM-WKZDHGJNSA-N,"InChI=1S/C38H60O12/c1-18-15-20(29(33(5,6)45)47-19(2)40)50-38(46)28(18)34(7)13-14-37-17-36(37)12-11-24(49-30-27(43)26(42)25(41)21(16-39)48-30)32(3,4)22(36)9-10-23(37)35(34,8)31(38)44/h10,18,20-22,24-31,39,41-46H,9,11-17H2,1-8H3/t18-,20-,21-,22+,24+,25+,26+,27-,28-,29-,30+,31-,34-,35-,36-,37+,38-/m1/s1",CC(=O)O[C@H]([C@H]1C[C@@H](C)[C@H]2[C@@](O)(O1)[C@H](O)[C@@]1(C)C3=CC[C@H]4C(C)(C)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C)C(C)(C)O,C38H60O12,pos_2_2proton,708.40847736,CNYNNXTXLZLYLM,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2424,5771,-1,,,,0.0,MS1_match,CNYNNXTXLZLYLM-WKZDHGJNSA-N,"InChI=1S/C38H60O12/c1-18-15-20(29(33(5,6)45)47-19(2)40)50-38(46)28(18)34(7)13-14-37-17-36(37)12-11-24(49-30-27(43)26(42)25(41)21(16-39)48-30)32(3,4)22(36)9-10-23(37)35(34,8)31(38)44/h10,18,20-22,24-31,39,41-46H,9,11-17H2,1-8H3/t18-,20-,21-,22+,24+,25+,26+,27-,28-,29-,30+,31-,34-,35-,36-,37+,38-/m1/s1",CC(=O)O[C@H]([C@H]1C[C@@H](C)[C@H]2[C@@](O)(O1)[C@H](O)[C@@]1(C)C3=CC[C@H]4C(C)(C)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C)C(C)(C)O,C38H60O12,pos_2_2proton,708.40847736,CNYNNXTXLZLYLM,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2425,5769,-1,,,,0.0,MS1_match,FILRFEXGRQEKMM-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)14(7)23-5-8(6)18)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,FILRFEXGRQEKMM,Terpenoids,Monoterpenoids,,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2426,5769,-1,,,,0.0,MS1_match,DPBCFTHDJGXWRI-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(19)16(2,14(7)23-5-8(6)18)25-15-13(22)12(21)11(20)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,DPBCFTHDJGXWRI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2427,5769,-1,,,,0.0,MS1_match,DBLVGADGVDUSHJ-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2428,5769,-1,,,,0.0,MS1_match,DBLVGADGVDUSHJ-RLIMOHGTSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7+,8-,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 2429,5769,-1,,,,0.0,MS1_match,RAKWYUWXLTYDQR-LTPIHACHSA-N,"InChI=1S/C16H26O9/c1-6-7-2-10(8(3-17)9(7)5-23-15(6)22)24-16-14(21)13(20)12(19)11(4-18)25-16/h6-14,16-21H,2-5H2,1H3/t6-,7-,8-,9+,10+,11-,12-,13+,14-,16-/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]21,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,RAKWYUWXLTYDQR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 2430,5769,-1,,,,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1acetonitrile,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2431,5769,-1,,,,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1acetonitrile,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 2432,5768,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HGZGMSVCFBWKLH-UHFFFAOYSA-N,"InChI=1S/C11H10O6/c12-8-3-1-7(5-9(8)13)2-4-11(16)17-6-10(14)15/h1-5,12-13H,6H2,(H,14,15)",O=C(O)COC(=O)C=Cc1ccc(O)c(O)c1,C11H10O6,pos_2MH,238.04773804,HGZGMSVCFBWKLH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,1,6.5 2433,5764,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,CMNDLCZGXCIKSM-UCEGJLSESA-N,"InChI=1S/C22H26O6/c1-19(2)12-10-16-21(4)15(26-17(23)14-8-6-5-7-9-14)11-13-20(3,25)22(21,28-19)18(24)27-16/h5-10,12,15-16,25H,11,13H2,1-4H3/t15-,16-,20-,21-,22+/m0/s1",CC1(C)C=C[C@@H]2OC(=O)[C@]3(O1)[C@@]2(C)[C@@H](OC(=O)c1ccccc1)CC[C@]3(C)O,C22H26O6,pos_1_1proton1methanol,386.172938552,CMNDLCZGXCIKSM,Terpenoids,Sesquiterpenoids,Secoeudesmane sesquiterpenoids,Mortonia latisepala,50596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Mortonia'],['Mortonia hidalgensis'],6,2,7.0 2434,5764,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,CMNDLCZGXCIKSM-UCEGJLSESA-N,"InChI=1S/C22H26O6/c1-19(2)12-10-16-21(4)15(26-17(23)14-8-6-5-7-9-14)11-13-20(3,25)22(21,28-19)18(24)27-16/h5-10,12,15-16,25H,11,13H2,1-4H3/t15-,16-,20-,21-,22+/m0/s1",CC1(C)C=C[C@@H]2OC(=O)[C@]3(O1)[C@@]2(C)[C@@H](OC(=O)c1ccccc1)CC[C@]3(C)O,C22H26O6,pos_1_1proton1methanol,386.172938552,CMNDLCZGXCIKSM,Terpenoids,Sesquiterpenoids,Secoeudesmane sesquiterpenoids,Mortonia hidalgensis,50596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Mortonia'],['Mortonia hidalgensis'],6,2,7.0 2435,5764,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,CMNDLCZGXCIKSM-LHXUZLEUSA-N,"InChI=1S/C22H26O6/c1-19(2)12-10-16-21(4)15(26-17(23)14-8-6-5-7-9-14)11-13-20(3,25)22(21,28-19)18(24)27-16/h5-10,12,15-16,25H,11,13H2,1-4H3/t15-,16+,20-,21-,22-/m0/s1",CC1(C)C=C[C@H]2OC(=O)[C@@]3(O1)[C@@]2(C)[C@@H](OC(=O)c1ccccc1)CC[C@]3(C)O,C22H26O6,pos_1_1proton1methanol,386.172938552,CMNDLCZGXCIKSM,Terpenoids,Sesquiterpenoids,Secoeudesmane sesquiterpenoids,Mortonia greggii,755538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Mortonia'],['Mortonia greggii'],6,2,7.0 2436,5764,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,CMNDLCZGXCIKSM-UHFFFAOYSA-N,"InChI=1S/C22H26O6/c1-19(2)12-10-16-21(4)15(26-17(23)14-8-6-5-7-9-14)11-13-20(3,25)22(21,28-19)18(24)27-16/h5-10,12,15-16,25H,11,13H2,1-4H3",CC1(C)C=CC2OC(=O)C3(O1)C(C)(O)CCC(OC(=O)c1ccccc1)C23C,C22H26O6,pos_1_1proton1methanol,386.172938552,CMNDLCZGXCIKSM,Terpenoids,Sesquiterpenoids,Secoeudesmane sesquiterpenoids,Mortonia diffusa,623426.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Mortonia'],['Mortonia diffusa'],6,2,7.0 2437,5759,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IKIIZLYTISPENI-ZFORQUDYSA-N,"InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2cc3oc(-c4ccccc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O11,pos_1_1proton,446.084911396,IKIIZLYTISPENI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum baicalense,1045100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum baicalense'],6,2,7.0 2438,5758,-1,,,,0.44507796,ISDB,NWOCYFGKUMMLPD-IIYHAVRMSA-N,"InChI=1S/C36H36O20/c37-11-22-26(46)29(49)33(54-24(45)6-2-13-1-4-16(40)18(42)7-13)35(52-22)56-34-30(50)27(47)23(12-38)53-36(34)55-32-28(48)25-20(44)9-15(39)10-21(25)51-31(32)14-3-5-17(41)19(43)8-14/h1-10,22-23,26-27,29-30,33-44,46-47,49-50H,11-12H2/b6-2+/t22-,23-,26+,27+,29+,30-,33-,34+,35-,36-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@@H](CO)[C@@H](O)[C@H]1O,C36H36O20,,788.179993552,NWOCYFGKUMMLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus,387812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Unknown'],6,0,7.780311822891235 2439,5758,-1,,,,0.44507796,ISDB,NWOCYFGKUMMLPD-ZJNIXLGPSA-N,"InChI=1S/C36H36O20/c37-11-22-26(46)29(49)33(54-24(45)6-2-13-1-4-16(40)18(42)7-13)35(52-22)56-34-30(50)27(47)23(12-38)53-36(34)55-32-28(48)25-20(44)9-15(39)10-21(25)51-31(32)14-3-5-17(41)19(43)8-14/h1-10,22-23,26-27,29-30,33-44,46-47,49-50H,11-12H2/b6-2+/t22-,23-,26-,27-,29+,30+,33-,34-,35+,36+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C36H36O20,,788.179993552,NWOCYFGKUMMLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,7.780311822891235 2440,5757,-1,,,,0.0,MS1_match,JUJTUEBXXGRSJB-MTAKFWDWSA-N,"InChI=1S/C17H26O9/c1-3-9-10-4-12(22-2)23-6-8(10)7-24-16(9)26-17-15(21)14(20)13(19)11(5-18)25-17/h3,7,9-21H,1,4-6H2,2H3/t9-,10-,11-,12-,13-,14+,15-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2CO[C@@H](OC)C[C@H]21,C17H26O9,pos_1_1proton1methanol,374.1576824119999,JUJTUEBXXGRSJB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2441,5756,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.57944757,ISDB,BYDQKMZEOZVIJM-ZGCJARKRSA-N,"InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,8-9H,7,10H2,1-4H3/b6-5-,12-9-",C/C=C\C=C1\C(C)=CCCC1(C)C,C13H20,,176.15650064,BYDQKMZEOZVIJM,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Passiflora edulis,183517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora edulis'],4,1,6.817790269851685 2442,5755,1455,Alkaloids,Flavonoids,Flavones,0.0,MS1_match,FEJTUHSIRAJLOJ-UHFFFAOYSA-N,"InChI=1S/C13H14N2O3/c1-8-6-9-11(10(16)7-8)12(13(17)18)15-5-3-2-4-14(9)15/h6-7H,2-5H2,1H3,(H,17,18)",Cc1cc2n3n(c(C(=O)O)c-2c(=O)c1)CCCC3,C13H14N2O3,pos_2MHNH3,246.100442308,FEJTUHSIRAJLOJ,Alkaloids,,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,1,6.5 2443,5751,1391,Terpenoids,Diterpenoids,Abietane diterpenoids,0.36378208,ISDB,JVRVYDCPTHHIGR-UHFFFAOYSA-N,"InChI=1S/C19H28O2/c1-11(2)14-10-12-7-8-15-13(6-5-9-19(15,3)4)16(12)18(21)17(14)20/h10-11,13,15,20-21H,5-9H2,1-4H3",CC(C)c1cc2c(c(O)c1O)C1CCCC(C)(C)C1CC2,C19H28O2,,288.208930136,JVRVYDCPTHHIGR,Terpenoids,Diterpenoids,Abietane diterpenoids,Rosmarinus officinalis,778824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia rosmarinus'],4,3,6.955128312110901 2444,5748,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.6251245,ISDB,USMNOWBWPHYOEA-MRTMQBJTSA-N,"InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1",CC(C)[C@]12CC(=O)[C@H](C)[C@H]1C2,C10H16O,,152.120115132,USMNOWBWPHYOEA,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,2,9.500498056411743 2445,5744,-1,,,,0.0,MS1_match,RFTKPXQZIVKVOP-PMQCXRHVSA-N,"InChI=1S/C16H20O9/c1-23-10-4-2-8(6-9(10)18)3-5-12(19)25-16-15(22)14(21)13(20)11(7-17)24-16/h2-6,11,13-18,20-22H,7H2,1H3/b5-3+/t11-,13-,14+,15-,16+/m1/s1",COc1ccc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C16H20O9,pos_2MNa,356.11073222,RFTKPXQZIVKVOP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 2446,5737,-1,,,,0.0,MS1_match,KZPZRTMZTKSHGK-ZLBDBGBFSA-N,"InChI=1S/C28H32O17/c1-40-12-6-11(32)15-19(36)25(23(43-24(15)18(12)35)9-2-4-10(31)5-3-9)44-28-26(21(38)17(34)14(8-30)42-28)45-27-22(39)20(37)16(33)13(7-29)41-27/h2-6,13-14,16-17,20-22,26-35,37-39H,7-8H2,1H3/t13-,14-,16-,17-,20+,21+,22-,26-,27+,28-/m1/s1",COc1cc(O)c2c(=O)c(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(-c3ccc(O)cc3)oc2c1O,C28H32O17,pos_1_1proton,640.163949564,KZPZRTMZTKSHGK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sardous,928421.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sardous'],6,0,6.0 2447,5736,-1,,,,0.0,MS1_match,CVLKSGMETVVYCI-KEOMQFIYSA-N,"InChI=1S/C28H32O16/c1-37-15-7-11-3-5-13(15)41-27-23(33)21(31)19(29)17(43-27)10-40-26(36)12-4-6-14(16(8-12)38-2)42-28-24(34)22(32)20(30)18(44-28)9-39-25(11)35/h3-8,17-24,27-34H,9-10H2,1-2H3/t17-,18-,19-,20-,21-,22+,23-,24-,27-,28-/m1/s1",COc1cc2ccc1O[C@@H]1O[C@H](COC(=O)c3ccc(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C28H32O16,pos_2_2sodium,624.169034944,CVLKSGMETVVYCI,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 2448,5736,-1,,,,0.0,MS1_match,CVLKSGMETVVYCI-KEOMQFIYSA-N,"InChI=1S/C28H32O16/c1-37-15-7-11-3-5-13(15)41-27-23(33)21(31)19(29)17(43-27)10-40-26(36)12-4-6-14(16(8-12)38-2)42-28-24(34)22(32)20(30)18(44-28)9-39-25(11)35/h3-8,17-24,27-34H,9-10H2,1-2H3/t17-,18-,19-,20-,21-,22+,23-,24-,27-,28-/m1/s1",COc1cc2ccc1O[C@@H]1O[C@H](COC(=O)c3ccc(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C28H32O16,pos_2_2sodium,624.169034944,CVLKSGMETVVYCI,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 2449,5735,715,Shikimates and Phenylpropanoids,Isoflavonoids,Pterocarpan,0.67812705,ISDB,XWPFSIAQJJWHLN-IERDGZPVSA-N,"InChI=1S/C23H24O6/c1-12(2)5-6-13-7-15-21-16(10-26-22(15)23(25-4)20(13)24-3)14-8-18-19(28-11-27-18)9-17(14)29-21/h5,7-9,16,21H,6,10-11H2,1-4H3/t16-,21+/m1/s1",COc1c(CC=C(C)C)cc2c(c1OC)OC[C@@H]1c3cc4c(cc3O[C@@H]21)OCO4,C23H24O6,,396.157288488,XWPFSIAQJJWHLN,Shikimates and Phenylpropanoids,Isoflavonoids,Pterocarpan,Neorautanenia mitis,324035.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Neorautanenia'],['Neorautanenia mitis'],4,3,8.212508201599121 2450,5735,715,Shikimates and Phenylpropanoids,Isoflavonoids,Pterocarpan,0.67812705,ISDB,XWPFSIAQJJWHLN-IERDGZPVSA-N,"InChI=1S/C23H24O6/c1-12(2)5-6-13-7-15-21-16(10-26-22(15)23(25-4)20(13)24-3)14-8-18-19(28-11-27-18)9-17(14)29-21/h5,7-9,16,21H,6,10-11H2,1-4H3/t16-,21+/m1/s1",COc1c(CC=C(C)C)cc2c(c1OC)OC[C@@H]1c3cc4c(cc3O[C@@H]21)OCO4,C23H24O6,,396.157288488,XWPFSIAQJJWHLN,Shikimates and Phenylpropanoids,Isoflavonoids,Pterocarpan,Neorautanenia amboensis,3922100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Neorautanenia'],['Neorautanenia amboensis'],4,3,8.212508201599121 2451,5734,-1,,,,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,0,6.0 2452,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sphaerospermus,1033259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sphaerospermus'],6,0,6.0 2453,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis var. diffusus,5264025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,0,6.0 2454,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis,491491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,0,6.0 2455,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus penicillatus,492327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus penicillatus'],6,0,6.0 2456,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 2457,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,6.0 2458,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus rionii,593374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus rionii'],6,0,6.0 2459,5734,-1,,,,0.0,MS1_match,BNSCASRSSGJHQH-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-9-4-12(32)16-13(5-9)41-24(8-1-2-10(30)11(31)3-8)25(19(16)35)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,BNSCASRSSGJHQH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,6.0 2460,5734,-1,,,,0.0,MS1_match,BNSCASRSSGJHQH-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-9-4-12(32)16-13(5-9)41-24(8-1-2-10(30)11(31)3-8)25(19(16)35)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,BNSCASRSSGJHQH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,0,6.0 2461,5734,-1,,,,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,0,6.0 2462,5734,-1,,,,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,0,6.0 2463,5734,-1,,,,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,0,6.0 2464,5734,-1,,,,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,0,6.0 2465,5734,-1,,,,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,0,6.0 2466,5734,-1,,,,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,0,6.0 2467,5734,-1,,,,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,0,6.0 2468,5734,-1,,,,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,0,6.0 2469,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus hederaceus,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,0,6.0 2470,5734,-1,,,,0.0,MS1_match,RDUAJIJVNHKTQC-IROKYFGSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14?,15?,17-,18-,20?,21?,22-,25?,26+,27+/m1/s1",O=c1c(O[C@@H]2OC(CO)[C@@H](O)C(O)C2O[C@@H]2OC(CO)[C@@H](O)C(O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_sodium,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus ololeucos,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,0,6.0 2471,5732,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,AZUURFWEIQDHCN-MZGJNUFDSA-N,"InChI=1S/C40H44O22/c1-14-25(46)29(50)31(52)38(55-14)56-17-10-20(45)24-21(11-17)57-33(16-7-8-18(43)19(44)9-16)35(28(24)49)61-40-36(30(51)26(47)22(12-41)59-40)62-39-32(53)34(27(48)23(13-42)58-39)60-37(54)15-5-3-2-4-6-15/h2-11,14,22-23,25-27,29-32,34,36,38-48,50-53H,12-13H2,1H3/t14-,22+,23+,25-,26+,27+,29+,30-,31+,32+,34-,36+,38+,39-,40-/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](OC(=O)c5ccccc5)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C40H44O22,pos_2_2proton,876.232423048,AZUURFWEIQDHCN,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium carolinianum,529153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carolinianum'],6,3,7.5 2472,5731,-1,,,,0.0,MS1_match,PBLWZMSRSJTRHJ-NCIRKIHRSA-N,"InChI=1S/C32H44O16/c1-42-20-8-14(3-5-18(20)45-31-28(40)26(38)24(36)22(11-34)47-31)7-16-13-44-30(17(16)10-33)15-4-6-19(21(9-15)43-2)46-32-29(41)27(39)25(37)23(12-35)48-32/h3-6,8-9,16-17,22-41H,7,10-13H2,1-2H3/t16-,17-,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H44O16,pos_1_sodium,684.262935328,PBLWZMSRSJTRHJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 2473,5728,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2474,5728,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2475,5726,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.4133054,ISDB,RLGBUTVIBWFTRW-IIEYBPOLSA-N,"InChI=1S/C27H36O3/c1-24(2)20-11-13-27-12-10-18(26(4,30)16-27)14-21(27)25(20,3)15-19(23(24)29)22(28)17-8-6-5-7-9-17/h5-10,12,18-22,28,30H,11,13-16H2,1-4H3/t18-,19+,20+,21-,22+,25+,26-,27+/m0/s1",CC1(C)C(=O)[C@@H]([C@H](O)c2ccccc2)C[C@]2(C)[C@@H]1CC[C@@]13C=C[C@@H](C[C@H]12)[C@@](C)(O)C3,C27H36O3,,408.266445012,RLGBUTVIBWFTRW,Terpenoids,Diterpenoids,Atisane diterpenoids,Androstachys johnsonii,510615.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Picrodendraceae'],['Unknown'],['Androstachys'],['Androstachys johnsonii'],0,1,2.153221607208252 2476,5724,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,PBLWZMSRSJTRHJ-NCIRKIHRSA-N,"InChI=1S/C32H44O16/c1-42-20-8-14(3-5-18(20)45-31-28(40)26(38)24(36)22(11-34)47-31)7-16-13-44-30(17(16)10-33)15-4-6-19(21(9-15)43-2)46-32-29(41)27(39)25(37)23(12-35)48-32/h3-6,8-9,16-17,22-41H,7,10-13H2,1-2H3/t16-,17-,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H44O16,pos_1_1proton1ammonium,684.262935328,PBLWZMSRSJTRHJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,9.0 2477,5723,-1,,,,0.63628805,ISDB,IQBMWEYFKNVACH-WYXVZEBFSA-N,"InChI=1S/C33H40O22/c34-6-15-19(41)23(45)26(48)31(50-15)54-29-24(46)20(42)17(8-36)52-33(29)55-30-25(47)21(43)16(7-35)51-32(30)53-28-22(44)18-13(40)4-10(37)5-14(18)49-27(28)9-1-2-11(38)12(39)3-9/h1-5,15-17,19-21,23-26,29-43,45-48H,6-8H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C33H40O22,,788.20112292,IQBMWEYFKNVACH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,8.545152187347412 2478,5718,-1,,,,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2479,5718,-1,,,,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2480,5718,-1,,,,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 2481,5718,-1,,,,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2482,5718,-1,,,,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 2483,5718,-1,,,,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 2484,5717,69,Terpenoids,Sesquiterpenoids,Furans,0.57329744,ISDB,OUWXZGMEFZQYEK-WQLSENKSSA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(8-12(4)16(17)18)15-11(3)7-10(2)14(9)15/h8-10,13-14H,5-7H2,1-4H3,(H,17,18)/b12-8-",CC1=C2C(/C=C(/C)C(=O)O)CCC(C)C2C(C)C1,C16H24O2,,248.177630008,OUWXZGMEFZQYEK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,9.293189764022827 2485,5713,-1,,,,0.0,MS1_match,LTXSRTCDWQZECA-BCBCZSNPSA-N,"InChI=1S/C26H34O10/c1-15(9-10-33-20-12-18-17(11-19(20)32-3)7-8-22(28)35-18)5-4-6-16(2)14-34-26-25(31)24(30)23(29)21(13-27)36-26/h6-9,11-12,21,23-27,29-31H,4-5,10,13-14H2,1-3H3/b15-9+,16-6-/t21-,23+,24-,25-,26+/m0/s1",COc1cc2ccc(=O)oc2cc1OC/C=C(\C)CC/C=C(/C)CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C26H34O10,pos_1_sodium,506.215197288,LTXSRTCDWQZECA,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Coptis trifolia,982768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis trifolia'],6,0,6.0 2486,5710,1015,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.4874609,ISDB,VINQZMMOIPTITQ-QWYWWIDCSA-N,"InChI=1S/C48H78O18/c1-22-38(66-41-36(57)33(54)31(52)26(64-41)20-61-39-35(56)32(53)30(51)25(19-49)63-39)34(55)37(58)40(62-22)65-29-11-12-44(4)27(45(29,5)21-50)10-13-47(7)28(44)9-8-23-24-18-43(2,3)14-16-48(24,42(59)60)17-15-46(23,47)6/h8,22,24-41,49-58H,9-21H2,1-7H3,(H,59,60)/t22-,24-,25+,26+,27+,28+,29-,30+,31+,32-,33-,34-,35+,36+,37+,38-,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@]5(C(=O)O)CC[C@]34C)[C@]2(C)CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C48H78O18,,942.518815656,VINQZMMOIPTITQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria transsylvanica,3892197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria transsylvanica'],6,3,9.449843645095825 2487,5707,-1,,,,0.0,MS1_match,VJPHRAFHYZGASA-FLPVFDBPSA-N,"InChI=1S/C25H36O10/c1-7-15(4)9-22(29)35-24-23-19(18(12-32-24)11-31-16(5)26)10-20(34-21(28)8-14(2)3)25(23,30)13-33-17(6)27/h10,12,14-15,20,23-24,30H,7-9,11,13H2,1-6H3/t15-,20+,23-,24+,25-/m0/s1",CC[C@H](C)CC(=O)O[C@H]1OC=C(COC(C)=O)C2=C[C@@H](OC(=O)CC(C)C)[C@@](O)(COC(C)=O)[C@@H]21,C25H36O10,pos_1_1potassium,496.230847352,VJPHRAFHYZGASA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2488,5707,-1,,,,0.0,MS1_match,GWGCPLJQSZLBJE-JEORNDINSA-N,"InChI=1S/C25H36O10/c1-7-14(4)8-20(28)35-24-21-18(9-19(33-15(5)26)25(21)12-32-25)17(11-31-24)10-30-23(29)22(13(2)3)34-16(6)27/h11,13-14,18-19,21-22,24H,7-10,12H2,1-6H3/t14-,18+,19-,21+,22+,24-,25+/m0/s1",CC[C@H](C)CC(=O)O[C@@H]1OC=C(COC(=O)[C@H](OC(C)=O)C(C)C)[C@H]2C[C@H](OC(C)=O)[C@]3(CO3)[C@@H]12,C25H36O10,pos_1_1potassium,496.230847352,GWGCPLJQSZLBJE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,0,6.0 2489,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-GDCKJWNLSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/t20-/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,0,6.925210952758789 2490,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-KTKRTIGZSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Saposhnikovia divaricata,737496.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Saposhnikovia'],['Saposhnikovia divaricata'],4,0,6.925210952758789 2491,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-KTKRTIGZSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Nelumbo nucifera,532288.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Proteales'],['Nelumbonaceae'],['Unknown'],['Nelumbo'],['Nelumbo nucifera'],4,0,6.925210952758789 2492,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-KTKRTIGZSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Chamaecrista greggii,3916645.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Chamaecrista'],['Chamaecrista greggii'],4,0,6.925210952758789 2493,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-QJRAZLAKSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/t20-/m0/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Senna tora,1084528.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Senna'],['Senna tora'],4,0,6.925210952758789 2494,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-QJRAZLAKSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/t20-/m0/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Melia azedarach,916052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Melia'],['Melia azedarach'],4,0,6.925210952758789 2495,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-QJRAZLAKSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/t20-/m0/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Senna obtusifolia,335059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Senna'],['Senna obtusifolia'],4,0,6.925210952758789 2496,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-UHFFFAOYSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3",CCCCCCCCC=CCCCCCCCC(=O)OCC(O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Bauhinia,560314.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Bauhinia'],['Unknown'],4,0,6.925210952758789 2497,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-QJRAZLAKSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/t20-/m0/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Oryza sativa,709894.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Oryzeae'],['Oryza'],['Oryza sativa'],4,0,6.925210952758789 2498,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-QJRAZLAKSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/t20-/m0/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Perilla frutescens,295678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Elsholtzieae'],['Perilla'],['Perilla frutescens'],4,0,6.925210952758789 2499,5705,-1,,,,0.73130274,ISDB,RZRNAYUHWVFMIP-SQUSKLHYSA-N,"InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9+/t20-/m1/s1",CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@H](O)CO,C21H40O4,,356.29265975999994,RZRNAYUHWVFMIP,Fatty acids,Glycerolipids,Monoacylglycerols,Bauhinia purpurea,560318.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Bauhinia'],['Bauhinia purpurea'],4,0,6.925210952758789 2500,5698,380,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,0.34970754,ISDB,ZNJCOKLSWJWJJU-NYNLCMDTSA-N,"InChI=1S/C14H16O3/c1-7-5-13-10(8(2)14(16)17-13)6-11-9(7)3-4-12(11)15/h7,10,13H,2-6H2,1H3/t7-,10+,13-/m0/s1",C=C1C(=O)O[C@H]2C[C@H](C)C3=C(C[C@H]12)C(=O)CC3,C14H16O3,,232.109944372,ZNJCOKLSWJWJJU,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,Mikania mendocina,7604044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Mikania'],['Mikania mendocina'],4,3,6.89883017539978 2501,5696,27,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VJPHRAFHYZGASA-FLPVFDBPSA-N,"InChI=1S/C25H36O10/c1-7-15(4)9-22(29)35-24-23-19(18(12-32-24)11-31-16(5)26)10-20(34-21(28)8-14(2)3)25(23,30)13-33-17(6)27/h10,12,14-15,20,23-24,30H,7-9,11,13H2,1-6H3/t15-,20+,23-,24+,25-/m0/s1",CC[C@H](C)CC(=O)O[C@H]1OC=C(COC(C)=O)C2=C[C@@H](OC(=O)CC(C)C)[C@@](O)(COC(C)=O)[C@@H]21,C25H36O10,pos_1_1potassium,496.230847352,VJPHRAFHYZGASA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 2502,5696,27,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWGCPLJQSZLBJE-JEORNDINSA-N,"InChI=1S/C25H36O10/c1-7-14(4)8-20(28)35-24-21-18(9-19(33-15(5)26)25(21)12-32-25)17(11-31-24)10-30-23(29)22(13(2)3)34-16(6)27/h11,13-14,18-19,21-22,24H,7-10,12H2,1-6H3/t14-,18+,19-,21+,22+,24-,25+/m0/s1",CC[C@H](C)CC(=O)O[C@@H]1OC=C(COC(=O)[C@H](OC(C)=O)C(C)C)[C@H]2C[C@H](OC(C)=O)[C@]3(CO3)[C@@H]12,C25H36O10,pos_1_1potassium,496.230847352,GWGCPLJQSZLBJE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 2503,5694,-1,,,,0.30442086,ISDB,,,,,,,FLQFEHUBZHWSIB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2176834344863892 2504,5688,-1,,,,0.21914183,ISDB,CAEDYXLYBKMFFK-BCGQYMPOSA-N,"InChI=1S/C43H70O6/c1-9-10-11-12-13-14-15-16-17-20-39(45)48-27-18-19-38-36(33(4)30-44)25-26-42(8,47)43(38)29-35(49-40(43)46)28-31(2)21-24-37-32(3)22-23-34(5)41(37,6)7/h21,24,28,30,34-35,38,40,46-47H,9-20,22-23,25-27,29H2,1-8H3/b24-21+,31-28+,36-33-/t34-,35-,38+,40+,42-,43-/m0/s1",CCCCCCCCCCCC(=O)OCCC[C@@H]1/C(=C(/C)C=O)CC[C@](C)(O)[C@@]12C[C@H](/C=C(C)/C=C/C1=C(C)CC[C@H](C)C1(C)C)O[C@H]2O,C43H70O6,,682.51723996,CAEDYXLYBKMFFK,Terpenoids,Diterpenoids,Labdane diterpenoids,Iris hoogiana,248945.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Iridaceae'],['Irideae'],['Iris'],['Iris hoogiana'],4,0,4.876567304134369 2505,5687,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.60063124,ISDB,VAGGDCACZPJMFS-OPOXAECZSA-N,"InChI=1S/C19H36O5/c1-3-4-5-9-12-17(21)18(22)15-14-16(20)11-8-6-7-10-13-19(23)24-2/h14-18,20-22H,3-13H2,1-2H3/b15-14+/t16-,17+,18+/m1/s1",CCCCCC[C@H](O)[C@@H](O)/C=C/[C@H](O)CCCCCCC(=O)OC,C19H36O5,,344.256274252,VAGGDCACZPJMFS,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Sambucus williamsii,589181.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Sambucus'],['Sambucus williamsii'],5,3,8.902524948120117 2506,5686,-1,,,,0.0,MS1_match,YWOADMLJMDWHTM-SDSRGVLNSA-N,"InChI=1S/C49H62O27/c1-12-29-30(13-14-50)32(16-64-46(29)75-48-42(70-27(9)57)40(68-25(7)55)38(66-23(5)53)35(73-48)18-62-21(3)51)45(60)72-34-15-31-33(44(59)61-11)17-65-47(37(31)20(34)2)76-49-43(71-28(10)58)41(69-26(8)56)39(67-24(6)54)36(74-49)19-63-22(4)52/h12,14,16-17,20,29-31,34-43,46-49H,1,13,15,18-19H2,2-11H3/t20-,29+,30-,31+,34-,35+,36+,37+,38+,39+,40-,41-,42+,43+,46-,47-,48-,49-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)[C@@H]3[C@H]2C)[C@H]1CC=O,C49H62O27,pos_2_1proton1potassium,1082.3478467240002,YWOADMLJMDWHTM,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Diabelia spathulata,1002192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Diabelia'],['Diabelia spathulata'],6,0,6.0 2507,5686,-1,,,,0.0,MS1_match,YWOADMLJMDWHTM-SDSRGVLNSA-N,"InChI=1S/C49H62O27/c1-12-29-30(13-14-50)32(16-64-46(29)75-48-42(70-27(9)57)40(68-25(7)55)38(66-23(5)53)35(73-48)18-62-21(3)51)45(60)72-34-15-31-33(44(59)61-11)17-65-47(37(31)20(34)2)76-49-43(71-28(10)58)41(69-26(8)56)39(67-24(6)54)36(74-49)19-63-22(4)52/h12,14,16-17,20,29-31,34-43,46-49H,1,13,15,18-19H2,2-11H3/t20-,29+,30-,31+,34-,35+,36+,37+,38+,39+,40-,41-,42+,43+,46-,47-,48-,49-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)[C@@H]3[C@H]2C)[C@H]1CC=O,C49H62O27,pos_2_1proton1potassium,1082.3478467240002,YWOADMLJMDWHTM,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Diabelia serrata,576351.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Diabelia'],['Diabelia serrata'],6,0,6.0 2508,5684,972,Terpenoids,Apocarotenoids,Pyridine alkaloids,0.0,MS1_match,UEEFSWPSRLSUQJ-NOMYRAODSA-N,"InChI=1S/C25H31NO11/c1-2-15-16(8-7-14-5-3-9-26(11-14)10-4-6-19(28)29)17(23(33)34)13-35-24(15)37-25-22(32)21(31)20(30)18(12-27)36-25/h2-3,5,7-9,11,13,15-16,18,20-22,24-25,27,30-32H,1,4,6,10,12H2,(H-,28,29,33,34)/b8-7+/t15-,16+,18-,20-,21+,22-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCCC(=O)O)c1,C25H31NO11,pos_2_2proton1acetonitrile,521.1897108119997,UEEFSWPSRLSUQJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2509,5684,972,Terpenoids,Apocarotenoids,Pyridine alkaloids,0.0,MS1_match,QGCICTMJHHIGBT-LSWTWQANSA-N,"InChI=1S/C25H31NO11/c1-4-15-16(7-6-13-8-14(22(31)32)10-26(5-2)9-13)17(23(33)34-3)12-35-24(15)37-25-21(30)20(29)19(28)18(11-27)36-25/h4,6-10,12,15-16,18-21,24-25,27-30H,1,5,11H2,2-3H3/b7-6+/t15-,16+,18-,19-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)[O-])c[n+](CC)c1,C25H31NO11,pos_2_2proton1acetonitrile,521.1897108119998,QGCICTMJHHIGBT,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2510,5678,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_2_1proton1sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum revolutum,421843.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum revolutum'],6,0,6.0 2511,5678,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_2_1proton1sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 2512,5678,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_2_1proton1sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lucidum,977702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lucidum'],6,0,6.0 2513,5678,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_2_1proton1sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum rugosum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 2514,5677,-1,,,,0.0,MS1_match,DKGYTSKPMLWLEI-FIZOKRMRSA-N,"InChI=1S/C10H14O4/c1-5-2-3-6-7(9(11)12)4-14-10(13)8(5)6/h4-6,8,10,13H,2-3H2,1H3,(H,11,12)/t5-,6+,8+,10+/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O)[C@@H]21,C10H14O4,pos_1_1proton1acetonitrile,198.089208928,DKGYTSKPMLWLEI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 2515,5676,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,IBAJNOZMACNWJD-HVUPOBLPSA-N,"InChI=1S/C41H66O11/c1-21-28(43)30(45)31(46)33(50-21)52-32-29(44)24(42)20-49-34(32)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27-,28-,29-,30+,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O11,pos_1_1proton1isopropanol,734.4605129320003,IBAJNOZMACNWJD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,1,8.5 2516,5676,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,IBAJNOZMACNWJD-DDGZBKDGSA-N,"InChI=1S/C41H66O11/c1-21-28(43)30(45)31(46)33(50-21)52-32-29(44)24(42)20-49-34(32)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27+,28-,29-,30+,31+,32+,33-,34-,38+,39-,40-,41+/m1/s1",C[C@H]1O[C@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@H](CC[C@]5(C)[C@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)C3(C)C)OC[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C41H66O11,pos_1_1proton1isopropanol,734.460512932,IBAJNOZMACNWJD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,1,8.5 2517,5676,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,IBAJNOZMACNWJD-HVUPOBLPSA-N,"InChI=1S/C41H66O11/c1-21-28(43)30(45)31(46)33(50-21)52-32-29(44)24(42)20-49-34(32)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27-,28-,29-,30+,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O11,pos_1_1proton1isopropanol,734.4605129320003,IBAJNOZMACNWJD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,1,8.5 2518,5676,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,IBAJNOZMACNWJD-DDGZBKDGSA-N,"InChI=1S/C41H66O11/c1-21-28(43)30(45)31(46)33(50-21)52-32-29(44)24(42)20-49-34(32)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27+,28-,29-,30+,31+,32+,33-,34-,38+,39-,40-,41+/m1/s1",C[C@H]1O[C@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@H](CC[C@]5(C)[C@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)C3(C)C)OC[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C41H66O11,pos_1_1proton1isopropanol,734.460512932,IBAJNOZMACNWJD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,1,8.5 2519,5668,134,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,0.32783237,ISDB,ICZVDXDXJQCDOJ-UHFFFAOYSA-N,"InChI=1S/C10H11NO3/c1-5-8(12)3-6-7(9(5)14-2)4-11-10(6)13/h3,12H,4H2,1-2H3,(H,11,13)",COc1c(C)c(O)cc2c1CNC2=O,C10H11NO3,,193.073893212,ICZVDXDXJQCDOJ,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,Althaea armeniaca,447106.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Althaea'],['Althaea armeniaca'],4,3,6.811329483985901 2520,5668,134,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,0.32783237,ISDB,ICZVDXDXJQCDOJ-UHFFFAOYSA-N,"InChI=1S/C10H11NO3/c1-5-8(12)3-6-7(9(5)14-2)4-11-10(6)13/h3,12H,4H2,1-2H3,(H,11,13)",COc1c(C)c(O)cc2c1CNC2=O,C10H11NO3,,193.073893212,ICZVDXDXJQCDOJ,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,Althaea officinalis,643492.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Althaea'],['Althaea officinalis'],4,3,6.811329483985901 2521,5668,134,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,0.32783237,ISDB,ICZVDXDXJQCDOJ-UHFFFAOYSA-N,"InChI=1S/C10H11NO3/c1-5-8(12)3-6-7(9(5)14-2)4-11-10(6)13/h3,12H,4H2,1-2H3,(H,11,13)",COc1c(C)c(O)cc2c1CNC2=O,C10H11NO3,,193.073893212,ICZVDXDXJQCDOJ,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,Sonchus maritimus,501725.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus maritimus'],4,3,6.811329483985901 2522,5668,134,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,0.32783237,ISDB,ICZVDXDXJQCDOJ-UHFFFAOYSA-N,"InChI=1S/C10H11NO3/c1-5-8(12)3-6-7(9(5)14-2)4-11-10(6)13/h3,12H,4H2,1-2H3,(H,11,13)",COc1c(C)c(O)cc2c1CNC2=O,C10H11NO3,,193.073893212,ICZVDXDXJQCDOJ,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,Sonchus asper,761937.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus asper'],4,3,6.811329483985901 2523,5667,474,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,LTRLDPJSMLPKMF-YKXWAFRCSA-N,"InChI=1S/C25H40O10/c1-12-9-14(26)10-25(3,4)15(12)6-5-13(2)34-24-23(32)22(31)21(30)18(35-24)11-33-17-8-7-16(27)19(28)20(17)29/h5-6,9,13,15-24,27-32H,7-8,10-11H2,1-4H3/b6-5+/t13-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2CC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O10,pos_2_1proton1potassium,500.26214748,LTRLDPJSMLPKMF,Terpenoids,Apocarotenoids,Megastigmanes,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 2524,5665,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.63717526,ISDB,NCCLLRBZVMPSLE-HEWQUDLHSA-N,"InChI=1S/C26H30O10/c1-14(2)3-6-16-12-17(28)7-9-20(16)34-26-24(33)23(32)25(21(13-27)35-26)36-22(31)10-5-15-4-8-18(29)19(30)11-15/h3-5,7-12,21,23-30,32-33H,6,13H2,1-2H3/b10-5+/t21-,23-,24-,25-,26-/m1/s1",CC(C)=CCc1cc(O)ccc1O[C@@H]1O[C@H](CO)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O)[C@H]1O,C26H30O10,,502.18389716,NCCLLRBZVMPSLE,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Phagnalon rupestre,96923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Phagnalon'],['Phagnalon rupestre'],4,3,8.048701047897339 2525,5664,1322,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HRJAUSFIYSBLLI-VODSTRMTSA-N,"InChI=1S/C35H40O10/c1-21(36)41-26-20-33(5,40)35-29(42-22(2)37)25(32(3,4)45-35)19-27(43-31(39)24-15-11-8-12-16-24)34(35,6)30(26)44-28(38)18-17-23-13-9-7-10-14-23/h7-18,25-27,29-30,40H,19-20H2,1-6H3/b18-17+/t25-,26+,27+,29-,30+,33+,34-,35+/m1/s1",CC(=O)O[C@H]1C[C@](C)(O)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(C)[C@H]1OC(=O)/C=C/c1ccccc1)[C@H]3OC(C)=O,C35H40O10,pos_1_1potassium,620.26214748,HRJAUSFIYSBLLI,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,3,8.5 2526,5664,1322,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,RACYNKLBFZMILD-UHFFFAOYSA-N,"InChI=1S/C35H40O10/c1-22(36)41-21-34-28(43-29(38)17-16-24-12-8-6-9-13-24)18-26-19-35(34,45-32(26,3)4)33(5,40)20-27(42-23(2)37)30(34)44-31(39)25-14-10-7-11-15-25/h6-17,26-28,30,40H,18-21H2,1-5H3",CC(=O)OCC12C(OC(=O)C=Cc3ccccc3)CC3CC1(OC3(C)C)C(C)(O)CC(OC(C)=O)C2OC(=O)c1ccccc1,C35H40O10,pos_1_1potassium,620.26214748,RACYNKLBFZMILD,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,3,8.5 2527,5662,-1,,,,0.0,MS1_match,BKATZVAUANSCKN-QWRGUYRKSA-N,"InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1",CC(=O)OCC1=CC[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_2MCH3CNNa,194.130679816,BKATZVAUANSCKN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2528,5662,-1,,,,0.0,MS1_match,PBWRFXQNNGSAQG-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3",C=C1C(OC(C)=O)CC2(C(C)C)CC12,C12H18O2,pos_2MCH3CNNa,194.130679816,PBWRFXQNNGSAQG,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2529,5662,-1,,,,0.0,MS1_match,ALVJDUNBMKMTDC-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-12(2,3)10-8-9(13-4)6-7-11(10)14-5/h6-8H,1-5H3",COc1ccc(OC)c(C(C)(C)C)c1,C12H18O2,pos_2MCH3CNNa,194.130679816,ALVJDUNBMKMTDC,Shikimates and Phenylpropanoids,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2530,5662,-1,,,,0.0,MS1_match,RWENJYLCELUBAE-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-8(2)10-6-11(13-4)9(3)12(7-10)14-5/h6-8H,1-5H3",COc1cc(C(C)C)cc(OC)c1C,C12H18O2,pos_2MCH3CNNa,194.130679816,RWENJYLCELUBAE,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2531,5662,-1,,,,0.0,MS1_match,GVZSSHYAFJPRJY-GARJFASQSA-N,"InChI=1S/C12H18O2/c1-7-10-5-9(12(7,3)4)6-11(10)14-8(2)13/h9-11H,1,5-6H2,2-4H3/t9-,10-,11+/m0/s1",C=C1[C@@H]2C[C@@H](C[C@H]2OC(C)=O)C1(C)C,C12H18O2,pos_2MCH3CNNa,194.130679816,GVZSSHYAFJPRJY,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2532,5662,-1,,,,0.0,MS1_match,OZBFUQLOVFXDNK-VWYCJHECSA-N,"InChI=1S/C12H18O2/c1-7-5-11(14-8(2)13)10-6-9(7)12(10,3)4/h5,9-11H,6H2,1-4H3/t9-,10+,11+/m1/s1",CC(=O)O[C@H]1C=C(C)[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_2MCH3CNNa,194.130679816,OZBFUQLOVFXDNK,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2533,5659,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7211522,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Piper philippinum,290828.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper nudibaccatum'],4,3,8.384608745574951 2534,5659,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7211522,ISDB,VEZIKIAGFYZTCI-YVMONPNESA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3/b8-5-",COC(=O)/C=C\c1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Haplophyllum latifolium,762596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum latifolium'],4,3,8.384608745574951 2535,5659,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7211522,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Scrophularia buergeriana,764427.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Scrophularia'],['Scrophularia buergeriana'],4,3,8.384608745574951 2536,5659,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7211522,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Gmelina asiatica,3883027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Gmelina'],['Gmelina asiatica'],4,3,8.384608745574951 2537,5659,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7211522,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Sideritis infernalis,218370.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis infernalis'],4,3,8.384608745574951 2538,5659,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7211522,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Philotheca obovalis,6126545.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Philotheca'],['Philotheca obovalis'],4,3,8.384608745574951 2539,5658,-1,,,,0.0,MS1_match,BSOLHSZWRMTETL-ZHXJFFNMSA-N,"InChI=1S/C23H27NO11/c1-2-13-14(6-5-12-4-3-7-24(8-12)9-17(26)27)15(21(31)32)11-33-22(13)35-23-20(30)19(29)18(28)16(10-25)34-23/h2-8,11,13-14,16,18-20,22-23,25,28-30H,1,9-10H2,(H-,26,27,31,32)/b6-5+/t13-,14+,16-,18-,19+,20-,22+,23+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CC(=O)O)c1,C23H27NO11,pos_1_1sodium1acetonitrile,493.158410684,BSOLHSZWRMTETL,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2540,5656,474,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,CKMFMNKEBARFNU-OFNKIYASSA-N,"InChI=1S/C23H27N3O3/c27-21-15-20(17-7-2-1-3-8-17)24-13-11-23(29)16-26(14-6-12-25-21)22(28)18-9-4-5-10-19(18)23/h1-5,7-10,20,24,29H,6,11-16H2,(H,25,27)/t20-,23+/m1/s1",O=C1C[C@H](c2ccccc2)NCC[C@]2(O)CN(CCCN1)C(=O)c1ccccc12,C23H27N3O3,pos_1_1potassium,393.205241724,CKMFMNKEBARFNU,,,,Gymnosporia mossambicensis,617157.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia mossambicensis'],6,0,6.0 2541,5654,-1,,,,0.23436171,ISDB,NCJBMKOLGAKGTI-KSSFIOAISA-N,"InChI=1S/C18H20N2O3/c21-17(22)18(16-9-12-3-1-2-4-15(12)20-16)11-23-8-6-13-10-19-7-5-14(13)18/h1-4,6,9,14,19-20H,5,7-8,10-11H2,(H,21,22)/t14-,18-/m0/s1",O=C(O)[C@@]1(c2cc3ccccc3[nH]2)COCC=C2CNCC[C@@H]21,C18H20N2O3,,312.1473925,NCJBMKOLGAKGTI,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Alstonia scholaris,749453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Alstonieae'],['Alstonia'],['Alstonia scholaris'],4,0,4.93744683265686 2542,5654,-1,,,,0.23436171,ISDB,NCJBMKOLGAKGTI-KSSFIOAISA-N,"InChI=1S/C18H20N2O3/c21-17(22)18(16-9-12-3-1-2-4-15(12)20-16)11-23-8-6-13-10-19-7-5-14(13)18/h1-4,6,9,14,19-20H,5,7-8,10-11H2,(H,21,22)/t14-,18-/m0/s1",O=C(O)[C@@]1(c2cc3ccccc3[nH]2)COCC=C2CNCC[C@@H]21,C18H20N2O3,,312.1473925,NCJBMKOLGAKGTI,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Alstonia angustiloba,5784611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Alstonieae'],['Alstonia'],['Alstonia angustiloba'],4,0,4.93744683265686 2543,5650,-1,,,,0.0,MS1_match,MRJOSYQMJVDQDS-UHFFFAOYSA-N,"InChI=1S/C39H60O11/c1-19(16-22(47-20(2)40)32-35(6,7)50-32)27-29(43)31(45)37(9)25-11-10-24-34(4,5)26(12-13-38(24)18-39(25,38)15-14-36(27,37)8)49-33-30(44)28(42)23(17-46-33)48-21(3)41/h19,22-28,30-33,42,44-45H,10-18H2,1-9H3",CC(=O)OC1COC(OC2CCC34CC35CCC3(C)C(C(C)CC(OC(C)=O)C6OC6(C)C)C(=O)C(O)C3(C)C5CCC4C2(C)C)C(O)C1O,C39H60O11,pos_1_1proton2acetonitrile,704.41356274,MRJOSYQMJVDQDS,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 2544,5650,-1,,,,0.0,MS1_match,DEEGQLBLXWGMCY-HNGFUVDTSA-N,"InChI=1S/C39H60O11/c1-19-16-23-30(34(6,7)48-21(3)41)50-39(49-23)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-28(46-20(2)40)27(43)22(42)17-45-31)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22+,23-,24+,25+,26+,27+,28-,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@H](O)[C@@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.41356274,DEEGQLBLXWGMCY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 2545,5650,-1,,,,0.0,MS1_match,DEEGQLBLXWGMCY-HNGFUVDTSA-N,"InChI=1S/C39H60O11/c1-19-16-23-30(34(6,7)48-21(3)41)50-39(49-23)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-28(46-20(2)40)27(43)22(42)17-45-31)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22+,23-,24+,25+,26+,27+,28-,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@H](O)[C@@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.41356274,DEEGQLBLXWGMCY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 2546,5650,-1,,,,0.0,MS1_match,DEEGQLBLXWGMCY-SDUBGERUSA-N,"InChI=1S/C39H60O11/c1-19-16-23-30(34(6,7)48-21(3)41)50-39(49-23)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-28(46-20(2)40)27(43)22(42)17-45-31)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27+,28-,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@@H](O)[C@@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.41356274,DEEGQLBLXWGMCY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea vaginata,512706.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea vaginata'],6,0,6.0 2547,5650,-1,,,,0.0,MS1_match,RQEFTCPCSKWKPF-SQLYFSCNSA-N,"InChI=1S/C39H60O11/c1-19-16-23-30(34(6,7)48-21(3)41)50-39(49-23)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-27(43)28(46-20(2)40)22(42)17-45-31)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27-,28+,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@@H]1[C@@H](O)[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.4135627400001,RQEFTCPCSKWKPF,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 2548,5650,-1,,,,0.0,MS1_match,RQEFTCPCSKWKPF-SQLYFSCNSA-N,"InChI=1S/C39H60O11/c1-19-16-23-30(34(6,7)48-21(3)41)50-39(49-23)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-27(43)28(46-20(2)40)22(42)17-45-31)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27-,28+,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@@H]1[C@@H](O)[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.4135627400001,RQEFTCPCSKWKPF,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea europaea,988733.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea europaea'],6,0,6.0 2549,5650,-1,,,,0.0,MS1_match,RQEFTCPCSKWKPF-SQLYFSCNSA-N,"InChI=1S/C39H60O11/c1-19-16-23-30(34(6,7)48-21(3)41)50-39(49-23)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-27(43)28(46-20(2)40)22(42)17-45-31)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27-,28+,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@@H]1[C@@H](O)[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.4135627400001,RQEFTCPCSKWKPF,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 2550,5650,-1,,,,0.0,MS1_match,RLSVGEYEJKPANX-SDUBGERUSA-N,"InChI=1S/C39H60O11/c1-19-16-22-30(34(6,7)48-21(3)41)50-39(49-22)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-28(43)27(42)23(17-45-31)46-20(2)40)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27+,28-,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@@H]1CO[C@@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)[C@H](O)[C@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.4135627400001,RLSVGEYEJKPANX,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea europaea,988733.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea europaea'],6,0,6.0 2551,5650,-1,,,,0.0,MS1_match,RLSVGEYEJKPANX-SDUBGERUSA-N,"InChI=1S/C39H60O11/c1-19-16-22-30(34(6,7)48-21(3)41)50-39(49-22)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-28(43)27(42)23(17-45-31)46-20(2)40)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27+,28-,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@@H]1CO[C@@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)[C@H](O)[C@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.4135627400001,RLSVGEYEJKPANX,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 2552,5650,-1,,,,0.0,MS1_match,RLSVGEYEJKPANX-SDUBGERUSA-N,"InChI=1S/C39H60O11/c1-19-16-22-30(34(6,7)48-21(3)41)50-39(49-22)29(19)35(8)14-15-38-18-37(38)13-12-26(47-31-28(43)27(42)23(17-45-31)46-20(2)40)33(4,5)24(37)10-11-25(38)36(35,9)32(39)44/h19,22-32,42-44H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27+,28-,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@@H]1CO[C@@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]7O[C@@]6(O[C@@H]7C(C)(C)OC(C)=O)[C@H](O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)[C@H](O)[C@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.4135627400001,RLSVGEYEJKPANX,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 2553,5650,-1,,,,0.0,MS1_match,HOEACCWXJIUNFZ-PJDTTXJDSA-N,"InChI=1S/C39H60O11/c1-19-16-23(32(35(6,7)45)48-21(3)41)49-29-27(19)36(8)14-15-39-18-38(39)13-12-26(50-33-30(47-20(2)40)28(43)22(42)17-46-33)34(4,5)24(38)10-11-25(39)37(36,9)31(29)44/h19,22-30,32-33,42-43,45H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27+,28+,29-,30-,32+,33+,36-,37-,38-,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@H]6[C@H](C)C[C@H]([C@H](OC(C)=O)C(C)(C)O)O[C@H]6C(=O)[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@@H](O)[C@@H]1O,C39H60O11,pos_1_1proton2acetonitrile,704.4135627400001,HOEACCWXJIUNFZ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea vaginata,512706.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea vaginata'],6,0,6.0 2554,5649,330,Terpenoids,Monoterpenoids,Pinane monoterpenoids,0.28334054,ISDB,,,,,,,RFESJZXTILAJHV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1333621740341187 2555,5648,1844,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,0.7051236,ISDB,GSSPKCPIRDPBQE-UHFFFAOYSA-N,"InChI=1S/C17H14O2/c1-3-11-8-13(18)9-12-4-5-14-10(2)16(19)7-6-15(14)17(11)12/h3-9,18-19H,1H2,2H3",C=Cc1cc(O)cc2ccc3c(C)c(O)ccc3c12,C17H14O2,,250.099379688,GSSPKCPIRDPBQE,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,Juncus setchuensis,3964818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Juncaceae'],['Unknown'],['Juncus'],['Juncus setchuensis'],4,3,8.320494413375854 2556,5648,1844,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,0.7051236,ISDB,GSSPKCPIRDPBQE-UHFFFAOYSA-N,"InChI=1S/C17H14O2/c1-3-11-8-13(18)9-12-4-5-14-10(2)16(19)7-6-15(14)17(11)12/h3-9,18-19H,1H2,2H3",C=Cc1cc(O)cc2ccc3c(C)c(O)ccc3c12,C17H14O2,,250.099379688,GSSPKCPIRDPBQE,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,Juncus effusus,26727.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Juncaceae'],['Unknown'],['Juncus'],['Juncus effusus'],4,3,8.320494413375854 2557,5648,1844,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,0.7051236,ISDB,GSSPKCPIRDPBQE-UHFFFAOYSA-N,"InChI=1S/C17H14O2/c1-3-11-8-13(18)9-12-4-5-14-10(2)16(19)7-6-15(14)17(11)12/h3-9,18-19H,1H2,2H3",C=Cc1cc(O)cc2ccc3c(C)c(O)ccc3c12,C17H14O2,,250.099379688,GSSPKCPIRDPBQE,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,Juncus acutus,437972.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Juncaceae'],['Unknown'],['Juncus'],['Juncus acutus'],4,3,8.320494413375854 2558,5647,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.35210556,ISDB,,,,,,,AYSWQYNATUUOGQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4084222316741943 2559,5646,-1,,,,0.0,MS1_match,HEYZWPRKKUGDCR-QBXMEVCASA-N,"InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@]21O,C16H22O10,pos_1_1proton1dmso,374.1212969039999,HEYZWPRKKUGDCR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2560,5646,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_1proton1dmso,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 2561,5646,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-GMHYLCIRSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)/t7?,8?,10-,11-,12+,13-,15+,16+/m1/s1",C=CC1C(CC=O)C(C(=O)O)=CO[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O10,pos_1_1proton1dmso,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2562,5646,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_1proton1dmso,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 2563,5646,-1,,,,0.0,MS1_match,HEYZWPRKKUGDCR-QBXMEVCASA-N,"InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@]21O,C16H22O10,pos_1_1proton1dmso,374.1212969039999,HEYZWPRKKUGDCR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2564,5646,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-GMHYLCIRSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)/t7?,8?,10-,11-,12+,13-,15+,16+/m1/s1",C=CC1C(CC=O)C(C(=O)O)=CO[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O10,pos_1_1proton1dmso,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2565,5644,-1,,,,0.31479165,ISDB,REZVXIYYURPOSL-SBNAJNSHSA-N,"InChI=1S/C20H22O7/c1-24-15-7-10(3-5-13(15)21)18-12-9-26-19(17(12)20(23)27-18)11-4-6-14(22)16(8-11)25-2/h3-8,12,17-23H,9H2,1-2H3/t12-,17-,18+,19+,20-/m0/s1",COc1cc([C@H]2O[C@H](O)[C@H]3[C@@H]2CO[C@@H]3c2ccc(O)c(OC)c2)ccc1O,C20H22O7,,374.1365530439999,REZVXIYYURPOSL,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Lonicera hypoleuca,5746397.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoleuca'],7,0,8.259166598320007 2566,5643,-1,,,,0.24795076,ISDB,XWOHZIIPBYAMJX-KHBMLBSESA-N,"InChI=1S/C11H16O5/c1-5-8(12)3-6-7(10(13)15-2)4-16-11(14)9(5)6/h4-6,8-9,11-12,14H,3H2,1-2H3/t5-,6+,8-,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C11H16O5,,228.099773612,XWOHZIIPBYAMJX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.991803050041199 2567,5641,501,,,,0.2688041,ISDB,,,,,,,NHJDIHHQSGBVGA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0752164125442505 2568,5639,766,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,JNPXCTROEJQHKD-KAZAEUKGSA-N,"InChI=1S/C21H30O13/c1-2-9-10-3-4-29-17(27)11(10)5-30-18(9)34-19-15(25)14(24)13(23)12(33-19)6-31-20-16(26)21(28,7-22)8-32-20/h2,5,9-10,12-16,18-20,22-26,28H,1,3-4,6-8H2/t9-,10-,12+,13+,14-,15+,16-,18-,19-,20+,21+/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C21H30O13,pos_2_1proton1potassium,490.16864102,JNPXCTROEJQHKD,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,3,8.5 2569,5638,326,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,0.37232682,ISDB,GYTISTMGTHKMCE-RMHXPDDSSA-N,"InChI=1S/C15H20O4/c1-7-5-8(16)6-9-10(17)11-12(19-11)13(14(2,3)18)15(7,9)4/h6-7,11-13,18H,5H2,1-4H3/t7-,11-,12-,13+,15+/m1/s1",C[C@@H]1CC(=O)C=C2C(=O)[C@H]3O[C@H]3[C@@H](C(C)(C)O)[C@]21C,C15H20O4,,264.13615912,GYTISTMGTHKMCE,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,8.989307284355164 2570,5637,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,VWFJDQUYCIWHTN-YFVJMOTDSA-N,"InChI=1S/C15H28O7P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-21-24(19,20)22-23(16,17)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H,19,20)(H2,16,17,18)/b14-9+,15-11+",CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O,C15H28O7P2,pos_1_1proton1dmso,382.131026496,VWFJDQUYCIWHTN,Terpenoids,Sesquiterpenoids,Farnesane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2571,5637,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,VWFJDQUYCIWHTN-YFVJMOTDSA-N,"InChI=1S/C15H28O7P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-21-24(19,20)22-23(16,17)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H,19,20)(H2,16,17,18)/b14-9+,15-11+",CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O,C15H28O7P2,pos_1_1proton1dmso,382.131026496,VWFJDQUYCIWHTN,Terpenoids,Sesquiterpenoids,Farnesane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2572,5630,-1,,,,0.5229137,ISDB,SBJOSYJXFBWYRQ-VZNAOLJHSA-N,"InChI=1S/C20H20O7/c1-25-16-13-14(6-8-15(16)21)7-9-19(24)27-20(12-10-18(22)23)11-4-3-5-17(20)26-2/h3-13,17,21H,1-2H3,(H,22,23)/b9-7+,12-10?",COc1cc(/C=C/C(=O)OC2(C=CC(=O)O)C=CC=CC2OC)ccc1O,C20H20O7,,372.12090298,SBJOSYJXFBWYRQ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Curcuma kwangsiensis,168279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Curcuma'],['Curcuma kwangsiensis'],4,0,6.0916547775268555 2573,5630,-1,,,,0.5229137,ISDB,SBJOSYJXFBWYRQ-VZNAOLJHSA-N,"InChI=1S/C20H20O7/c1-25-16-13-14(6-8-15(16)21)7-9-19(24)27-20(12-10-18(22)23)11-4-3-5-17(20)26-2/h3-13,17,21H,1-2H3,(H,22,23)/b9-7+,12-10?",COc1cc(/C=C/C(=O)OC2(C=CC(=O)O)C=CC=CC2OC)ccc1O,C20H20O7,,372.12090298,SBJOSYJXFBWYRQ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Curcuma chuanyujin,168353.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Curcuma'],['Curcuma chuanyujin'],4,0,6.0916547775268555 2574,5626,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_2MHNH3,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 2575,5626,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_2MHNH3,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2576,5624,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.44001406,ISDB,JNPXCTROEJQHKD-KAZAEUKGSA-N,"InChI=1S/C21H30O13/c1-2-9-10-3-4-29-17(27)11(10)5-30-18(9)34-19-15(25)14(24)13(23)12(33-19)6-31-20-16(26)21(28,7-22)8-32-20/h2,5,9-10,12-16,18-20,22-26,28H,1,3-4,6-8H2/t9-,10-,12+,13+,14-,15+,16-,18-,19-,20+,21+/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C21H30O13,,490.16864102,JNPXCTROEJQHKD,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,3,10.260056257247925 2577,5621,964,Terpenoids,Steroids,Amarylidaceae alkaloids,0.5504266,ISDB,HFYGXQFCFQNRAX-PMERELPUSA-N,"InChI=1S/C30H34N2O6/c1-31(2)14-13-21-16-25-26(38-19-37-25)17-22(21)18-30(34)23-10-11-24(35-3)28(36-4)27(23)29(33)32(30)15-12-20-8-6-5-7-9-20/h5-11,16-17,34H,12-15,18-19H2,1-4H3/t30-/m0/s1",COc1ccc2c(c1OC)C(=O)N(CCc1ccccc1)[C@]2(O)Cc1cc2c(cc1CCN(C)C)OCO2,C30H34N2O6,,518.241686808,HFYGXQFCFQNRAX,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Fumaria densiflora,793787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Fumaria'],['Fumaria densiflora'],4,3,7.701706409454346 2578,5618,1785,,,,0.36593592,ISDB,,,,,,,APGOMUSZAWBZHE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4637436866760254 2579,5617,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MNa,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 2580,5617,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MNa,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 2581,5616,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KKLONPANWKAOPP-DFEUVTCYSA-N,"InChI=1S/C24H29NO11/c1-3-14-15(6-5-12-7-13(21(30)31)9-25(4-2)8-12)16(22(32)33)11-34-23(14)36-24-20(29)19(28)18(27)17(10-26)35-24/h3,5-9,11,14-15,17-20,23-24,26-29H,1,4,10H2,2H3,(H-,30,31,32,33)/b6-5+/t14-,15+,17-,18-,19+,20-,23+,24+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1cc(C(=O)O)c[n+](CC)c1,C24H29NO11,pos_1_1proton1methanol,507.1740607479998,KKLONPANWKAOPP,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2582,5616,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ONSYQRQUUDJRLS-IRTUFKDUSA-N,"InChI=1S/C24H29NO11/c1-2-14-15(6-5-13-4-3-8-25(10-13)9-7-18(27)28)16(22(32)33)12-34-23(14)36-24-21(31)20(30)19(29)17(11-26)35-24/h2-6,8,10,12,14-15,17,19-21,23-24,26,29-31H,1,7,9,11H2,(H-,27,28,32,33)/b6-5+/t14-,15+,17-,19-,20+,21-,23+,24+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCC(=O)O)c1,C24H29NO11,pos_1_1proton1methanol,507.1740607479998,ONSYQRQUUDJRLS,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2583,5616,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,YEXJLSCDDBIEPB-DFEUVTCYSA-N,"InChI=1S/C24H29NO11/c1-4-14-15(6-5-12-7-13(21(30)31)9-25(2)8-12)16(22(32)33-3)11-34-23(14)36-24-20(29)19(28)18(27)17(10-26)35-24/h4-9,11,14-15,17-20,23-24,26-29H,1,10H2,2-3H3/b6-5+/t14-,15+,17-,18-,19+,20-,23+,24+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)[O-])c[n+](C)c1,C24H29NO11,pos_1_1proton1methanol,507.174060748,YEXJLSCDDBIEPB,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2584,5614,-1,,,,0.0,MS1_match,RMTHFMSBPWQULL-BJLHFBGVSA-N,"InChI=1S/C18H25NO8S/c1-2-8-9-5-12-19(3-4-28-12)16(24)10(9)7-25-17(8)27-18-15(23)14(22)13(21)11(6-20)26-18/h2,7-9,11-15,17-18,20-23H,1,3-6H2/t8-,9+,11-,12+,13-,14+,15-,17+,18+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCS[C@H]3C[C@H]21,C18H25NO8S,pos_2MNa,415.13008776,RMTHFMSBPWQULL,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera xylosteum,218830.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera xylosteum'],8,0,8.0 2585,5613,-1,,,,0.0,MS1_match,XQVQOVDNWBXCHM-HBGFXZTGSA-N,"InChI=1S/C25H32O14/c1-7-16-17(8-9-26)18(23(31)32-6)10-34-24(16)39-25-22(37-15(5)30)21(36-14(4)29)20(35-13(3)28)19(38-25)11-33-12(2)27/h7,9-10,16-17,19-22,24-25H,1,8,11H2,2-6H3/t16?,17?,19-,20-,21+,22-,24+,25+/m1/s1",C=CC1C(CC=O)C(C(=O)OC)=CO[C@H]1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C25H32O14,pos_1_1proton1methanol,556.179205704,XQVQOVDNWBXCHM,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2586,5612,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.20371087,ISDB,FLXYYVTUDYLYMR-GURFDTTISA-N,"InChI=1S/C20H30O13/c21-4-7-3-10(31-19-16(27)13(24)9(23)6-30-19)8-1-2-29-18(12(7)8)33-20-17(28)15(26)14(25)11(5-22)32-20/h1-3,8-28H,4-6H2/t8-,9+,10+,11+,12+,13-,14+,15-,16+,17+,18-,19-,20-/m0/s1",OCC1=C[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C20H30O13,,478.1686410199998,FLXYYVTUDYLYMR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Verbascum phlomoides,934439.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Verbascum'],['Verbascum phlomoides'],4,3,6.314843475818634 2587,5612,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.20371087,ISDB,FLXYYVTUDYLYMR-GURFDTTISA-N,"InChI=1S/C20H30O13/c21-4-7-3-10(31-19-16(27)13(24)9(23)6-30-19)8-1-2-29-18(12(7)8)33-20-17(28)15(26)14(25)11(5-22)32-20/h1-3,8-28H,4-6H2/t8-,9+,10+,11+,12+,13-,14+,15-,16+,17+,18-,19-,20-/m0/s1",OCC1=C[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C20H30O13,,478.1686410199998,FLXYYVTUDYLYMR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Verbascum sinuatum,717435.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Verbascum'],['Verbascum sinuatum'],4,3,6.314843475818634 2588,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-MODFVPIOSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+/t10-,11-,13-,14-,15+,16-,17-,19-/m1/s1",C[C@H](/C=C/[C@@]1(O)[C@H](C)CC(=O)CC1(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.20971798399984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Helicia cochinchinensis,835265.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Proteales'],['Proteaceae'],['Unknown'],['Helicia'],['Helicia cochinchinensis'],4,3,7.738309860229492 2589,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-AATRIKPKSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+",CC(/C=C/C1(O)C(C)CC(=O)CC1(C)C)OC1OC(CO)C(O)C(O)C1O,C19H32O8,,388.209717984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Betula platyphylla,731671.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Betulaceae'],['Unknown'],['Betula'],['Betula platyphylla'],4,3,7.738309860229492 2590,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-MODFVPIOSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+/t10-,11-,13-,14-,15+,16-,17-,19-/m1/s1",C[C@H](/C=C/[C@@]1(O)[C@H](C)CC(=O)CC1(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.20971798399984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Myrsine seguinii,659787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Myrsine'],['Myrsine seguinii'],4,3,7.738309860229492 2591,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-UAGWJTNKSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+/t10-,11+,13-,14-,15+,16-,17-,19-/m1/s1",C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.209717984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Laurus,571536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Laurus'],['Unknown'],4,3,7.738309860229492 2592,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-UAGWJTNKSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+/t10-,11+,13-,14-,15+,16-,17-,19-/m1/s1",C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.209717984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Artemisia chamaemelifolia,119282.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia chamaemelifolia'],4,3,7.738309860229492 2593,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-UAGWJTNKSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+/t10-,11+,13-,14-,15+,16-,17-,19-/m1/s1",C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.209717984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Artemisia gmelinii,115033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia gmelinii'],4,3,7.738309860229492 2594,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-UAGWJTNKSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+/t10-,11+,13-,14-,15+,16-,17-,19-/m1/s1",C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.209717984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Artemisia santolinifolia,154486.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia santolinifolia'],4,3,7.738309860229492 2595,5611,1375,Terpenoids,Apocarotenoids,Megastigmanes,0.55957747,ISDB,QFTPTUOKFIIFJH-UAGWJTNKSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+/t10-,11+,13-,14-,15+,16-,17-,19-/m1/s1",C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.209717984,QFTPTUOKFIIFJH,Terpenoids,Apocarotenoids,Megastigmanes,Artemisia stechmanniana,154486.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia santolinifolia'],4,3,7.738309860229492 2596,5608,-1,,,,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_1_1proton2acetonitrile,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 2597,5606,678,Alkaloids,Monoterpenoids,Terpenoid alkaloids,0.23407276,ISDB,WABSIBOPGQPWRD-VQHVLOKHSA-N,"InChI=1S/C14H24O6/c1-19-13(17)8-6-4-2-3-5-7-9-14(18)20-11-12(16)10-15/h7,9,12,15-16H,2-6,8,10-11H2,1H3/b9-7+",COC(=O)CCCCCC/C=C/C(=O)OCC(O)CO,C14H24O6,,288.157288488,WABSIBOPGQPWRD,,,,Cladosporium cladosporioides,187451.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Capnodiales'],['Cladosporiaceae'],['Unknown'],['Cladosporium'],['Cladosporium cladosporioides'],1,0,1.9362910389900208 2598,5605,-1,,,,0.0,MS1_match,RMTHFMSBPWQULL-BJLHFBGVSA-N,"InChI=1S/C18H25NO8S/c1-2-8-9-5-12-19(3-4-28-12)16(24)10(9)7-25-17(8)27-18-15(23)14(22)13(21)11(6-20)26-18/h2,7-9,11-15,17-18,20-23H,1,3-6H2/t8-,9+,11-,12+,13-,14+,15-,17+,18+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCS[C@H]3C[C@H]21,C18H25NO8S,pos_1_sodium,415.13008776,RMTHFMSBPWQULL,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera xylosteum,218830.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera xylosteum'],8,0,8.0 2599,5603,222,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_1_sodium,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 2600,5603,222,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_1_sodium,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 2601,5602,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.40575036,ISDB,OSEDKWKVFUDTBD-FMQYXTRESA-N,"InChI=1S/C23H19N5O5/c29-10-16-21(32)28-14-8-4-2-6-12(14)23(33)9-15-19(30)25-18(27(16)22(23)28)17-24-13-7-3-1-5-11(13)20(31)26(15)17/h1-8,15-16,18,22,29,33H,9-10H2,(H,25,30)/t15-,16-,18-,22+,23-/m0/s1",O=C1N[C@@H]2c3nc4ccccc4c(=O)n3[C@H]1C[C@]1(O)c3ccccc3N3C(=O)[C@H](CO)N2[C@H]31,C23H19N5O5,,445.138618708,OSEDKWKVFUDTBD,Alkaloids,Anthranilic acid alkaloids,Quinazoline alkaloids,Aspergillus versicolor,534823.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus versicolor'],1,1,3.123001456260681 2602,5601,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.86381984,ISDB,ADSYMQORONDIDD-TUYKCJADSA-N,"InChI=1S/C22H24O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-6,15,17,19-25,27-29H,7-8H2,1H3/t15-,17-,19-,20+,21-,22-/m1/s1",COc1ccc([C@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O,C22H24O11,,464.1318615879999,ADSYMQORONDIDD,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus reticulata,37136.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus reticulata'],4,3,8.955279350280762 2603,5601,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.86381984,ISDB,ADSYMQORONDIDD-TUYKCJADSA-N,"InChI=1S/C22H24O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-6,15,17,19-25,27-29H,7-8H2,1H3/t15-,17-,19-,20+,21-,22-/m1/s1",COc1ccc([C@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O,C22H24O11,,464.1318615879999,ADSYMQORONDIDD,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus deliciosa,83847.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus deliciosa'],4,3,8.955279350280762 2604,5601,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.86381984,ISDB,ADSYMQORONDIDD-ZJHVPRRPSA-N,"InChI=1S/C22H24O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-6,15,17,19-25,27-29H,7-8H2,1H3/t15-,17+,19+,20-,21+,22+/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O,C22H24O11,,464.131861588,ADSYMQORONDIDD,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Cunila,1097484.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Cunila'],['Unknown'],4,3,8.955279350280762 2605,5601,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.86381984,ISDB,ADSYMQORONDIDD-UHFFFAOYSA-N,"InChI=1S/C22H24O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-6,15,17,19-25,27-29H,7-8H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(OC4OC(CO)C(O)C(O)C4O)cc3O2)cc1O,C22H24O11,,464.131861588,ADSYMQORONDIDD,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Buddleja parviflora,790830.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Buddlejeae'],['Buddleja'],['Buddleja parviflora'],4,3,8.955279350280762 2606,5596,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_2MHNH3,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,3,9.5 2607,5596,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_2MHNH3,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,3,9.5 2608,5595,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.61106426,ISDB,QWMQZQPAPQHIFD-NYMRDAGRSA-N,"InChI=1S/C31H38O16/c1-14-23(38)25(40)26(41)30(43-14)47-28-27(46-22(37)9-7-16-6-8-18(34)20(36)12-16)21(13-32)45-31(29(28)44-15(2)33)42-11-10-17-4-3-5-19(35)24(17)39/h3-9,12,14,21,23,25-32,34-36,38-41H,10-11,13H2,1-2H3/b9-7+/t14-,21+,23-,25+,26+,27+,28-,29+,30-,31+/m0/s1",CC(=O)O[C@H]1[C@H](OCCc2cccc(O)c2O)O[C@H](CO)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O,C31H38O16,,666.215985136,QWMQZQPAPQHIFD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Rehmannia glutinosa,164453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Unknown'],['Rehmannia'],['Rehmannia glutinosa'],4,1,6.944257020950317 2609,5594,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_2_2proton,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 2610,5594,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_2_2proton,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,0,7.0 2611,5592,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GHPOIRJQBGGCSC-SPFBNEDVSA-N,"InChI=1S/C25H28O12/c1-2-12-13(8-15-17(19(28)23(33)35-15)11-6-4-3-5-7-11)14(22(31)32)10-34-24(12)37-25-21(30)20(29)18(27)16(9-26)36-25/h2-7,10,12-13,15-16,18,20-21,24-30H,1,8-9H2,(H,31,32)/t12-,13+,15-,16-,18-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O)[C@H]1C[C@H]1OC(=O)C(O)=C1c1ccccc1,C25H28O12,pos_1_1proton1methanol,520.1580763359998,GHPOIRJQBGGCSC,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 2612,5592,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JANONPLUBJJWRY-LDRWPHMTSA-N,"InChI=1S/C25H28O12/c1-2-12-13-8-15(17(19(28)22(31)32)11-6-4-3-5-7-11)35-23(33)14(13)10-34-24(12)37-25-21(30)20(29)18(27)16(9-26)36-25/h2-7,10,12-13,15-16,18,20-21,24-30H,1,8-9H2,(H,31,32)/b19-17+/t12-,13+,15-,16-,18-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@@H](/C(=C(/O)C(=O)O)c3ccccc3)C[C@H]21,C25H28O12,pos_1_1proton1methanol,520.1580763359999,JANONPLUBJJWRY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 2613,5591,242,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.7527692,ISDB,YUSWMAULDXZHPY-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-12,31-36H",O=c1cc(-c2ccc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c2)oc2cc(O)cc(O)c12,C30H18O10,,538.089996776,YUSWMAULDXZHPY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Leycesteria formosa,225983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Leycesteria'],['Leycesteria formosa'],6,3,10.51107668876648 2614,5590,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BXZYVDAASBLBQM-UHFFFAOYSA-N,"InChI=1S/C16H24O7/c1-8-6-22-16(9(2)3-4-10(8)16)7-21-15-14(20)13(19)12(18)11(5-17)23-15/h3,10-15,17-20H,1,4-7H2,2H3",C=C1COC2(COC3OC(CO)C(O)C(O)C3O)C(C)=CCC12,C16H24O7,pos_1_1proton1methanol,328.1522031079999,BXZYVDAASBLBQM,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 2615,5585,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton1ammonium,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,1,8.5 2616,5585,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton1ammonium,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,1,8.5 2617,5585,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton1ammonium,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,1,8.5 2618,5585,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton1ammonium,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,1,8.5 2619,5584,1395,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,UPJVQRZPXLZUET-KGHQQZOUSA-N,"InChI=1S/C28H46O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26,30)15-16-28(23,24)31/h7-8,15-16,18-24,29-31H,9-14,17H2,1-6H3/b8-7+/t19-,20+,21-,22+,23+,24+,25+,26+,27+,28-/m0/s1",CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@]3(O)C=C[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H46O3,pos_1_1proton1methanol,430.344695332,UPJVQRZPXLZUET,Terpenoids,Steroids,Cholestane steroids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 2620,5583,-1,,,,0.29082942,ISDB,CSTXPWMNQXGCDD-UHFFFAOYSA-N,"InChI=1S/C28H47NO2/c1-18(24-8-6-5-7-15-29(24)4)23-17-25(31)26-21-10-9-19-16-20(30)11-13-27(19,2)22(21)12-14-28(23,26)3/h9,18,20-26,30-31H,5-8,10-17H2,1-4H3",CC(C1CCCCCN1C)C1CC(O)C2C3CC=C4CC(O)CCC4(C)C3CCC12C,C28H47NO2,,429.360679744,CSTXPWMNQXGCDD,Terpenoids,Steroids,,Fritillaria walujewii,3966597.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Fritillaria'],['Fritillaria walujewii'],4,0,5.163317680358887 2621,5583,-1,,,,0.29082942,ISDB,CSTXPWMNQXGCDD-UHFFFAOYSA-N,"InChI=1S/C28H47NO2/c1-18(24-8-6-5-7-15-29(24)4)23-17-25(31)26-21-10-9-19-16-20(30)11-13-27(19,2)22(21)12-14-28(23,26)3/h9,18,20-26,30-31H,5-8,10-17H2,1-4H3",CC(C1CCCCCN1C)C1CC(O)C2C3CC=C4CC(O)CCC4(C)C3CCC12C,C28H47NO2,,429.360679744,CSTXPWMNQXGCDD,Terpenoids,Steroids,,Fritillaria bucharica,3966587.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Fritillaria'],['Fritillaria bucharica'],4,0,5.163317680358887 2622,5582,-1,,,,0.2972673,ISDB,SXCVPGXYCJAUPB-YLAKUSLOSA-N,"InChI=1S/C20H32O3/c1-13(2)15-7-8-20(6)11-16(9-14(3)17(20)10-15)23-18(21)12-19(4,5)22/h15-17,22H,1,3,7-12H2,2,4-6H3/t15-,16+,17+,20+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](OC(=O)CC(C)(C)O)CC(=C)[C@@H]2C1,C20H32O3,,320.235144884,SXCVPGXYCJAUPB,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,7.189069151878357 2623,5580,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,DARGUPSDBIBHDD-SNVBAGLBSA-N,"InChI=1S/C12H16O3/c1-5-10(13-2)9-6-7-11(14-3)12(8-9)15-4/h5-8,10H,1H2,2-4H3/t10-/m1/s1",C=C[C@@H](OC)c1ccc(OC)c(OC)c1,C12H16O3,pos_1_1proton1methanol,208.109944372,DARGUPSDBIBHDD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,3,7.5 2624,5575,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,HNZUNIKWNYHEJJ-FMIVXFBMSA-N,"InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+",CC(=O)CC/C=C(\C)CCC=C(C)C,C13H22O,pos_1_sodium,194.167065324,HNZUNIKWNYHEJJ,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 2625,5575,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,HNZUNIKWNYHEJJ-FMIVXFBMSA-N,"InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+",CC(=O)CC/C=C(\C)CCC=C(C)C,C13H22O,pos_1_sodium,194.167065324,HNZUNIKWNYHEJJ,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 2626,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-VMPITWQZSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)/b8-5+",NCCCCNC(=O)/C=C/c1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Colocasia esculenta,1008203.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Araceae'],['Colocasieae'],['Colocasia'],['Colocasia esculenta'],4,3,7.578437566757202 2627,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-UHFFFAOYSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)",NCCCCNC(=O)C=Cc1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,7.578437566757202 2628,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-VMPITWQZSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)/b8-5+",NCCCCNC(=O)/C=C/c1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Buxus natalensis,5232166.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Buxales'],['Buxaceae'],['Unknown'],['Buxus'],['Buxus natalensis'],4,3,7.578437566757202 2629,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-VMPITWQZSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)/b8-5+",NCCCCNC(=O)/C=C/c1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,7.578437566757202 2630,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-VMPITWQZSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)/b8-5+",NCCCCNC(=O)/C=C/c1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Cenchrus americanus,1079449.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Paniceae'],['Cenchrus'],['Cenchrus americanus'],4,3,7.578437566757202 2631,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-VMPITWQZSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)/b8-5+",NCCCCNC(=O)/C=C/c1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Solanum americanum,756802.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum americanum'],4,3,7.578437566757202 2632,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-VMPITWQZSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)/b8-5+",NCCCCNC(=O)/C=C/c1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,3,7.578437566757202 2633,5574,391,Alkaloids,Ornithine alkaloids,Polyamines,0.5196094,ISDB,CJHDBEPXEKGBDW-VMPITWQZSA-N,"InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)/b8-5+",NCCCCNC(=O)/C=C/c1ccc(O)cc1,C13H18N2O2,,234.136827816,CJHDBEPXEKGBDW,Alkaloids,Ornithine alkaloids,Polyamines,Persea americana,913249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Persea'],['Persea americana'],4,3,7.578437566757202 2634,5572,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.3477825,ISDB,,,,,,,AYSWQYNATUUOGQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.391129970550537 2635,5570,-1,,,,0.45717695,ISDB,NCHUIUBVZLLXAJ-DDKCOJEUSA-N,"InChI=1S/C26H40O12/c1-13(8-10-27)5-4-6-14(2)23(33)35-12-17-19(28)20(29)21(30)25(37-17)38-24-18-15(7-9-26(18,3)34)16(11-36-24)22(31)32/h6,11,13,15,17-21,24-25,27-30,34H,4-5,7-10,12H2,1-3H3,(H,31,32)/b14-6+/t13-,15+,17+,18+,19+,20-,21+,24-,25-,26-/m0/s1",C/C(=C\CC[C@H](C)CCO)C(=O)OC[C@H]1O[C@@H](O[C@@H]2OC=C(C(=O)O)[C@H]3CC[C@](C)(O)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O,C26H40O12,,544.25197672,NCHUIUBVZLLXAJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Vitex agnus-castus,988127.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Vitex'],['Vitex agnus-castus'],4,0,5.828707814216614 2636,5569,-1,,,,0.0,MS1_match,XWOHZIIPBYAMJX-KHBMLBSESA-N,"InChI=1S/C11H16O5/c1-5-8(12)3-6-7(10(13)15-2)4-16-11(14)9(5)6/h4-6,8-9,11-12,14H,3H2,1-2H3/t5-,6+,8-,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C11H16O5,pos_2MHNH3,228.099773612,XWOHZIIPBYAMJX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 2637,5569,-1,,,,0.0,MS1_match,HJTVDWWIPXDJBB-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-6(5-12)7-4-8(13)11(2,15)9(7)10(14)16-3/h5,7-9,13,15H,1,4H2,2-3H3",C=C(C=O)C1CC(O)C(C)(O)C1C(=O)OC,C11H16O5,pos_2MHNH3,228.099773612,HJTVDWWIPXDJBB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2638,5569,-1,,,,0.0,MS1_match,NGJFTIGDSFYTPY-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-11-7(12)3-5-6(4-15-11)10(14-2)16-9(13)8(5)11/h5-8,10,12H,3-4H2,1-2H3",COC1OC(=O)C2C3CC(O)C2(C)OCC13,C11H16O5,pos_2MHNH3,228.099773612,NGJFTIGDSFYTPY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2639,5569,-1,,,,0.0,MS1_match,CCTSZLOYMHLMHP-UHFFFAOYSA-N,"InChI=1S/C10H16O5/c1-10(14)7(12)2-6-5(3-11)4-15-9(13)8(6)10/h5-8,11-12,14H,2-4H2,1H3",CC1(O)C(O)CC2C(CO)COC(=O)C21,C10H16O5,pos_2MHCH3CN,216.099773612,CCTSZLOYMHLMHP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 2640,5568,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton1methanol,462.116211524,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 2641,5568,-1,,,,0.0,MS1_match,ULVBHEFDGPIWAT-BYXQHVMRSA-N,"InChI=1S/C22H22O11/c1-30-11-6-12(25)15-13(7-11)31-20(9-2-4-10(24)5-3-9)21(17(15)27)33-22-19(29)18(28)16(26)14(8-23)32-22/h2-7,14,16,18-19,22-26,28-29H,8H2,1H3/t14-,16-,18-,19-,22+/m1/s1",COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(-c3ccc(O)cc3)oc2c1,C22H22O11,pos_1_1proton1methanol,462.1162115239998,ULVBHEFDGPIWAT,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Glaucidium palmatum,889044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Glaucidium'],['Glaucidium palmatum'],6,0,6.0 2642,5568,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1methanol,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2643,5568,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1methanol,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2644,5568,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1methanol,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 2645,5568,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1methanol,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 2646,5568,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-SAEXZTQASA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5-/t19-,22-/m1/s1",COc1ccc(/C=C\C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1methanol,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2647,5568,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-SAEXZTQASA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5-/t19-,22-/m1/s1",COc1ccc(/C=C\C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1methanol,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2648,5568,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-SAEXZTQASA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5-/t19-,22-/m1/s1",COc1ccc(/C=C\C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1methanol,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 2649,5568,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-AHKCGJDQSA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1methanol,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 2650,5568,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-AHKCGJDQSA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1methanol,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 2651,5568,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-GSVZXUNASA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3/t15-,17-,19+,20-,22+/m1/s1",COc1ccc(-c2cc(=O)c3c(O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1methanol,462.1162115239998,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,0,6.0 2652,5568,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3",COc1ccc(-c2cc(=O)c3c(O)c(OC4OC(CO)C(O)C(O)C4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1methanol,462.116211524,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,0,6.0 2653,5568,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-GSVZXUNASA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3/t15-,17-,19+,20-,22+/m1/s1",COc1ccc(-c2cc(=O)c3c(O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1methanol,462.1162115239998,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,0,6.0 2654,5568,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3",COc1ccc(-c2cc(=O)c3c(O)c(OC4OC(CO)C(O)C(O)C4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1methanol,462.116211524,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,0,6.0 2655,5568,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-PGPONNFDSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton1methanol,462.1162115239999,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2656,5568,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton1methanol,462.116211524,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 2657,5568,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-PGPONNFDSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton1methanol,462.1162115239999,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2658,5568,-1,,,,0.0,MS1_match,ULVBHEFDGPIWAT-BYXQHVMRSA-N,"InChI=1S/C22H22O11/c1-30-11-6-12(25)15-13(7-11)31-20(9-2-4-10(24)5-3-9)21(17(15)27)33-22-19(29)18(28)16(26)14(8-23)32-22/h2-7,14,16,18-19,22-26,28-29H,8H2,1H3/t14-,16-,18-,19-,22+/m1/s1",COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(-c3ccc(O)cc3)oc2c1,C22H22O11,pos_1_1proton1methanol,462.1162115239998,ULVBHEFDGPIWAT,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Glaucidium palmatum,889044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Glaucidium'],['Glaucidium palmatum'],6,0,6.0 2659,5568,-1,,,,0.0,MS1_match,BTQPTWPZTSYUPW-AHKCGJDQSA-N,"InChI=1S/C22H22O11/c1-31-15-9-13(10-16(32-2)18(15)25)5-8-17(24)33-19(20(26)27)22(30,21(28)29)11-12-3-6-14(23)7-4-12/h3-10,19,23,25,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5+/t19-,22-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc(OC)c1O,C22H22O11,pos_1_1proton1methanol,462.1162115239999,BTQPTWPZTSYUPW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 2660,5566,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.5969189,ISDB,DOFYAVLOCYRMIV-ULTRRKBWSA-N,"InChI=1S/C36H38N4O6/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)45-7)32(39-25)31-33-30(34(42)36(31,44)35(43)46-8)19(6)26(40-33)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,37,40,44H,1,10-12H2,2-8H3/t18-,22-,36-/m0/s1",C=Cc1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C)=C6CC)c(C)c5C(=O)[C@]4(O)C(=O)OC)[C@@H](CCC(=O)OC)[C@@H]3C,C36H38N4O6,,622.2791349360001,DOFYAVLOCYRMIV,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Clerodendrum calamitosum,6086132.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum calamitosum'],4,3,7.887675523757935 2661,5565,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,WGTYXIDAEFJHPD-DJSGBOIRSA-N,"InChI=1S/C25H32O11/c1-33-17-9-13(4-5-16(17)29)23-15(10-27)14-7-12(3-2-6-26)8-18(24(14)36-23)34-25-22(32)21(31)20(30)19(11-28)35-25/h4-5,7-9,15,19-23,25-32H,2-3,6,10-11H2,1H3/t15-,19+,20+,21-,22+,23+,25+/m0/s1",COc1cc([C@H]2Oc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(CCCO)cc3[C@@H]2CO)ccc1O,C25H32O11,pos_1_1proton1ammonium,508.1944618439998,WGTYXIDAEFJHPD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 2662,5565,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,WGTYXIDAEFJHPD-DJSGBOIRSA-N,"InChI=1S/C25H32O11/c1-33-17-9-13(4-5-16(17)29)23-15(10-27)14-7-12(3-2-6-26)8-18(24(14)36-23)34-25-22(32)21(31)20(30)19(11-28)35-25/h4-5,7-9,15,19-23,25-32H,2-3,6,10-11H2,1H3/t15-,19+,20+,21-,22+,23+,25+/m0/s1",COc1cc([C@H]2Oc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(CCCO)cc3[C@@H]2CO)ccc1O,C25H32O11,pos_1_1proton1ammonium,508.1944618439998,WGTYXIDAEFJHPD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 2663,5564,-1,,,,0.0,MS1_match,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2proton,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],9,0,9.0 2664,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia elata,633797.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia elata'],4,2,7.2662975788116455 2665,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Cotinus coggygria,876714.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Cotinus'],['Cotinus coggygria'],4,2,7.2662975788116455 2666,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Rhus typhina,1010430.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Rhus'],['Rhus typhina'],4,2,7.2662975788116455 2667,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Prosopidastrum globosum,3918763.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Mimoseae'],['Prosopidastrum'],['Prosopidastrum globosum'],4,2,7.2662975788116455 2668,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Brucea javanica,841359.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Simaroubaceae'],['Unknown'],['Brucea'],['Brucea javanica'],4,2,7.2662975788116455 2669,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Gleditsia japonica,787616.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Gleditsia'],['Gleditsia japonica'],4,2,7.2662975788116455 2670,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Lawsonia inermis,996694.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Lawsonia'],['Lawsonia inermis'],4,2,7.2662975788116455 2671,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Robinia pseudoacacia,928416.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Robinieae'],['Robinia'],['Robinia pseudoacacia'],4,2,7.2662975788116455 2672,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Solanum pseudocapsicum,121218.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum pseudocapsicum'],4,2,7.2662975788116455 2673,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Toxicodendron vernicifluum,350856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Toxicodendron'],['Toxicodendron vernicifluum'],4,2,7.2662975788116455 2674,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Virgilia oroboides,761236.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Podalyrieae'],['Virgilia'],['Virgilia oroboides'],4,2,7.2662975788116455 2675,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia falciformis,867937.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia falciformis'],4,2,7.2662975788116455 2676,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Baptisia lecontei,3928764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Baptisia'],['Baptisia lecontei'],4,2,7.2662975788116455 2677,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia binervata,997695.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia binervata'],4,2,7.2662975788116455 2678,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia fimbriata,452614.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia fimbriata'],4,2,7.2662975788116455 2679,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia irrorata,1062318.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia irrorata'],4,2,7.2662975788116455 2680,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia vestita,660545.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia vestita'],4,2,7.2662975788116455 2681,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia trachyphloia,730413.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia trachyphloia'],4,2,7.2662975788116455 2682,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia parramattensis,60602.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia parramattensis'],4,2,7.2662975788116455 2683,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia lanigera,3917633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia lanigera'],4,2,7.2662975788116455 2684,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia deanei,103860.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia deanei'],4,2,7.2662975788116455 2685,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia decora,3918328.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia decora'],4,2,7.2662975788116455 2686,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia cardiophylla,639796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia cardiophylla'],4,2,7.2662975788116455 2687,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia buxifolia,3918242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia buxifolia'],4,2,7.2662975788116455 2688,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia silvestris,97456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia silvestris'],4,2,7.2662975788116455 2689,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia clunies-rossiae,3918081.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia clunies-rossiae'],4,2,7.2662975788116455 2690,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia dealbata,274405.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia dealbata'],4,2,7.2662975788116455 2691,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,7.2662975788116455 2692,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia carneorum,3918002.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia carneorum'],4,2,7.2662975788116455 2693,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia fasciculifera,633799.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia fasciculifera'],4,2,7.2662975788116455 2694,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia saxatilis,3918435.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia saxatilis'],4,2,7.2662975788116455 2695,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia crombiei,3918220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia crombiei'],4,2,7.2662975788116455 2696,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia peuce,3918125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia peuce'],4,2,7.2662975788116455 2697,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia leucoclada,1081334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia leucoclada'],4,2,7.2662975788116455 2698,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia terminalis,485967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia terminalis'],4,2,7.2662975788116455 2699,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia mollifolia,882772.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia mollifolia'],4,2,7.2662975788116455 2700,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia baileyana,639792.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia baileyana'],4,2,7.2662975788116455 2701,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia oshanesii,485960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia oshanesii'],4,2,7.2662975788116455 2702,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia neriifolia,618995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia neriifolia'],4,2,7.2662975788116455 2703,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia pycnantha,39866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia pycnantha'],4,2,7.2662975788116455 2704,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia cultriformis,1081327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia cultriformis'],4,2,7.2662975788116455 2705,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia kettlewelliae,3917832.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia kettlewelliae'],4,2,7.2662975788116455 2706,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia mabellae,1062323.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia mabellae'],4,2,7.2662975788116455 2707,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia calamifolia,867933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia calamifolia'],4,2,7.2662975788116455 2708,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia constablei,1062325.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia constablei'],4,2,7.2662975788116455 2709,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia chrysotricha,3918470.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia chrysotricha'],4,2,7.2662975788116455 2710,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia adunca,33827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia adunca'],4,2,7.2662975788116455 2711,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia mearnsii,343265.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia mearnsii'],4,2,7.2662975788116455 2712,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia filicifolia,1062329.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia filicifolia'],4,2,7.2662975788116455 2713,5560,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5665744,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia rubida,3918444.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia rubida'],4,2,7.2662975788116455 2714,5559,311,Terpenoids,Sesquiterpenoids,Noreremophilane sesquiterpenoids,0.22839613,ISDB,UGDVDUDNGSZKIS-HRVVTOCWSA-N,"InChI=1S/C29H38O3/c1-16-9-7-11-21-13-25-27(18(3)26(16)21)19(4)28(32-25)31-24-14-22-12-8-10-17(2)29(22,6)15-23(24)20(5)30/h13,16-17,22H,7-12,14-15H2,1-6H3/t16-,17-,22+,29+/m0/s1",CC(=O)C1=C(Oc2oc3cc4c(c(C)c3c2C)[C@@H](C)CCC4)C[C@H]2CCC[C@H](C)[C@@]2(C)C1,C29H38O3,,434.282095076,UGDVDUDNGSZKIS,Terpenoids,Sesquiterpenoids,Noreremophilane sesquiterpenoids,Ligularia muliensis,7051955.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia muliensis'],4,3,6.413584530353546 2715,5558,-1,,,,0.0,MS1_match,WGTYXIDAEFJHPD-DJSGBOIRSA-N,"InChI=1S/C25H32O11/c1-33-17-9-13(4-5-16(17)29)23-15(10-27)14-7-12(3-2-6-26)8-18(24(14)36-23)34-25-22(32)21(31)20(30)19(11-28)35-25/h4-5,7-9,15,19-23,25-32H,2-3,6,10-11H2,1H3/t15-,19+,20+,21-,22+,23+,25+/m0/s1",COc1cc([C@H]2Oc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(CCCO)cc3[C@@H]2CO)ccc1O,C25H32O11,pos_1_sodium,508.1944618439998,WGTYXIDAEFJHPD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 2716,5558,-1,,,,0.0,MS1_match,WGTYXIDAEFJHPD-DJSGBOIRSA-N,"InChI=1S/C25H32O11/c1-33-17-9-13(4-5-16(17)29)23-15(10-27)14-7-12(3-2-6-26)8-18(24(14)36-23)34-25-22(32)21(31)20(30)19(11-28)35-25/h4-5,7-9,15,19-23,25-32H,2-3,6,10-11H2,1H3/t15-,19+,20+,21-,22+,23+,25+/m0/s1",COc1cc([C@H]2Oc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(CCCO)cc3[C@@H]2CO)ccc1O,C25H32O11,pos_1_sodium,508.1944618439998,WGTYXIDAEFJHPD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 2717,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,ABRULANJVVJLFI-DGHBBABESA-N,"InChI=1S/C22H22O10/c1-30-13-7-14-16(11(25)6-12(31-14)9-2-4-10(24)5-3-9)19(27)17(13)22-21(29)20(28)18(26)15(8-23)32-22/h2-7,15,18,20-24,26-29H,8H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,ABRULANJVVJLFI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia oxysepala,949638.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia oxysepala'],6,0,6.0 2718,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,ABRULANJVVJLFI-DGHBBABESA-N,"InChI=1S/C22H22O10/c1-30-13-7-14-16(11(25)6-12(31-14)9-2-4-10(24)5-3-9)19(27)17(13)22-21(29)20(28)18(26)15(8-23)32-22/h2-7,15,18,20-24,26-29H,8H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,ABRULANJVVJLFI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia oxysepala,949638.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia oxysepala'],6,0,6.0 2719,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,HHPLIFSIFJSIBY-UHJXJGFFSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15?,18-,19-,20?,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1OC(CO)[C@H](O)[C@H](O)C1O,C22H22O10,pos_1_1proton1ammonium,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 2720,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,HHPLIFSIFJSIBY-PGPONNFDSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2721,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,HHPLIFSIFJSIBY-RZDNYABWSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18+,19-,20+,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1ammonium,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2722,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,HHPLIFSIFJSIBY-UHJXJGFFSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15?,18-,19-,20?,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1OC(CO)[C@H](O)[C@H](O)C1O,C22H22O10,pos_1_1proton1ammonium,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 2723,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,HHPLIFSIFJSIBY-PGPONNFDSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2724,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,HHPLIFSIFJSIBY-RZDNYABWSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18+,19-,20+,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1ammonium,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2725,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,SQGQTKZMNQBRTK-GWJBRELFSA-N,"InChI=1S/C22H22O10/c1-30-16-9-5-13(11-17(16)31-2)6-10-18(24)32-19(20(25)26)22(29,21(27)28)12-14-3-7-15(23)8-4-14/h3-11,19,23,29H,12H2,1-2H3,(H,25,26)(H,27,28)/b10-6+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1OC,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,SQGQTKZMNQBRTK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,0,6.0 2726,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,SQGQTKZMNQBRTK-GWJBRELFSA-N,"InChI=1S/C22H22O10/c1-30-16-9-5-13(11-17(16)31-2)6-10-18(24)32-19(20(25)26)22(29,21(27)28)12-14-3-7-15(23)8-4-14/h3-11,19,23,29H,12H2,1-2H3,(H,25,26)(H,27,28)/b10-6+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1OC,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,SQGQTKZMNQBRTK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 2727,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,SQGQTKZMNQBRTK-GWJBRELFSA-N,"InChI=1S/C22H22O10/c1-30-16-9-5-13(11-17(16)31-2)6-10-18(24)32-19(20(25)26)22(29,21(27)28)12-14-3-7-15(23)8-4-14/h3-11,19,23,29H,12H2,1-2H3,(H,25,26)(H,27,28)/b10-6+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1OC,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,SQGQTKZMNQBRTK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 2728,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,SQGQTKZMNQBRTK-GWJBRELFSA-N,"InChI=1S/C22H22O10/c1-30-16-9-5-13(11-17(16)31-2)6-10-18(24)32-19(20(25)26)22(29,21(27)28)12-14-3-7-15(23)8-4-14/h3-11,19,23,29H,12H2,1-2H3,(H,25,26)(H,27,28)/b10-6+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1OC,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,SQGQTKZMNQBRTK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2729,5557,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.0,MS1_match,SQGQTKZMNQBRTK-GWJBRELFSA-N,"InChI=1S/C22H22O10/c1-30-16-9-5-13(11-17(16)31-2)6-10-18(24)32-19(20(25)26)22(29,21(27)28)12-14-3-7-15(23)8-4-14/h3-11,19,23,29H,12H2,1-2H3,(H,25,26)(H,27,28)/b10-6+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc1OC,C22H22O10,pos_1_1proton1ammonium,446.1212969039999,SQGQTKZMNQBRTK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2730,5556,-1,,,,0.4549707,ISDB,,,,,,,OXCBLCXMXYMXFP,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.8198827505111694 2731,5553,-1,,,,0.0,MS1_match,JUQBPFGIFICIIN-UHFFFAOYSA-N,"InChI=1S/C20H21NO5/c1-21-6-5-13-8-18-19(26-11-25-18)9-14(13)17(23)7-12-3-4-16(22)20(24-2)15(12)10-21/h3-4,8-9,22H,5-7,10-11H2,1-2H3",COc1c(O)ccc2c1CN(C)CCc1cc3c(cc1C(=O)C2)OCO3,C20H21NO5,pos_1_1proton1ethylamine,355.1419727719999,JUQBPFGIFICIIN,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,0,6.0 2732,5553,-1,,,,0.0,MS1_match,YYPGFVKLIUMIEL-ZDUSSCGKSA-N,"InChI=1S/C20H21NO5/c1-22-14-7-10-6-13-16-11(4-5-21-13)18(24-3)20-19(25-9-26-20)17(16)12(10)8-15(14)23-2/h7-8,13,21H,4-6,9H2,1-3H3/t13-/m0/s1",COc1cc2c(cc1OC)-c1c3c(c(OC)c4c1[C@H](C2)NCC4)OCO3,C20H21NO5,pos_1_1proton1ethylamine,355.141972772,YYPGFVKLIUMIEL,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,0,6.0 2733,5553,-1,,,,0.0,MS1_match,CELDISJHFVNAQK-ZDUSSCGKSA-N,"InChI=1S/C20H21NO5/c1-21-5-4-11-16-13(21)6-10-7-14(22)15(23-2)8-12(10)17(16)19-20(18(11)24-3)26-9-25-19/h7-8,13,22H,4-6,9H2,1-3H3/t13-/m0/s1",COc1cc2c(cc1O)C[C@H]1c3c(c(OC)c4c(c3-2)OCO4)CCN1C,C20H21NO5,pos_1_1proton1ethylamine,355.141972772,CELDISJHFVNAQK,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum isopyroides,98291.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum isopyroides'],6,0,6.0 2734,5553,-1,,,,0.0,MS1_match,SZMVKWFJCYTPOI-UHFFFAOYSA-N,"InChI=1S/C20H21NO5/c1-22-14-7-10-6-13-16-11(4-5-21-13)18-20(26-9-25-18)19(24-3)17(16)12(10)8-15(14)23-2/h7-8,13,21H,4-6,9H2,1-3H3",COc1cc2c(cc1OC)-c1c(OC)c3c(c4c1C(C2)NCC4)OCO3,C20H21NO5,pos_1_1proton1ethylamine,355.141972772,SZMVKWFJCYTPOI,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum baicalense,1045100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum baicalense'],6,0,6.0 2735,5553,-1,,,,0.0,MS1_match,RRBNQGNYYACENK-UHFFFAOYSA-N,"InChI=1S/C20H21NO5/c1-21(22)7-6-13-9-18(23-2)20(24-3)19-14(13)5-4-12-8-16-17(10-15(12)19)26-11-25-16/h4-5,8-10,22H,6-7,11H2,1-3H3",COc1cc(CCN(C)O)c2ccc3cc4c(cc3c2c1OC)OCO4,C20H21NO5,pos_1_1proton1ethylamine,355.141972772,RRBNQGNYYACENK,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,0,6.0 2736,5553,-1,,,,0.0,MS1_match,ONEMAZREBSCOFF-HUUCEWRRSA-N,"InChI=1S/C20H21NO5/c1-21-14-4-10-5-17(23-2)18(24-3)8-11(10)15(21)6-13-12(14)7-16(22)20-19(13)25-9-26-20/h5,7-8,14-15,22H,4,6,9H2,1-3H3/t14-,15-/m1/s1",COc1cc2c(cc1OC)[C@H]1Cc3c(cc(O)c4c3OCO4)[C@@H](C2)N1C,C20H21NO5,pos_1_1proton1ethylamine,355.141972772,ONEMAZREBSCOFF,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,0,6.0 2737,5553,-1,,,,0.0,MS1_match,LSYKFBZWBDMZLQ-NRFANRHFSA-N,"InChI=1S/C23H29N3O2/c27-22-18-21(19-10-3-1-4-11-19)24-14-7-8-16-26(17-9-15-25-22)23(28)20-12-5-2-6-13-20/h1-6,10-13,21,24H,7-9,14-18H2,(H,25,27)/t21-/m0/s1",O=C1C[C@@H](c2ccccc2)NCCCCN(C(=O)c2ccccc2)CCCN1,C23H29N3O2,pos_1_sodium,379.225977168,LSYKFBZWBDMZLQ,Alkaloids,Ornithine alkaloids,Polyamines,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 2738,5553,-1,,,,0.0,MS1_match,LSYKFBZWBDMZLQ-NRFANRHFSA-N,"InChI=1S/C23H29N3O2/c27-22-18-21(19-10-3-1-4-11-19)24-14-7-8-16-26(17-9-15-25-22)23(28)20-12-5-2-6-13-20/h1-6,10-13,21,24H,7-9,14-18H2,(H,25,27)/t21-/m0/s1",O=C1C[C@@H](c2ccccc2)NCCCCN(C(=O)c2ccccc2)CCCN1,C23H29N3O2,pos_1_sodium,379.225977168,LSYKFBZWBDMZLQ,Alkaloids,Ornithine alkaloids,Polyamines,Gymnosporia mossambicensis,617157.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia mossambicensis'],6,0,6.0 2739,5552,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_1proton1ammonium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2740,5552,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_1proton1ammonium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2741,5552,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NFIQKUQYFSTGFU-VWZQPUASSA-N,"InChI=1S/C47H76O17/c1-42(2)14-16-47(41(58)64-40-37(57)34(54)32(52)26(62-40)21-60-38-36(56)33(53)31(51)25(19-48)61-38)17-15-45(6)22(23(47)18-42)8-9-28-44(5)12-11-29(43(3,4)27(44)10-13-46(28,45)7)63-39-35(55)30(50)24(49)20-59-39/h8,23-40,48-57H,9-21H2,1-7H3/t23-,24-,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38+,39-,40-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O17,pos_1_1proton1ammonium,912.5082509720002,NFIQKUQYFSTGFU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2742,5550,-1,,,,0.0,MS1_match,ZVQYCHMNZFFTTA-LZHBMSMKSA-N,"InChI=1S/C54H90O21/c1-23(19-55)9-10-28(57)24(2)27-13-15-52(8)32-12-11-31-50(5,6)33(14-16-53(31)22-54(32,53)18-17-51(27,52)7)73-47-43(67)40(64)44(26(4)70-47)74-49-45(75-48-42(66)37(61)34(58)25(3)69-48)39(63)36(60)30(72-49)21-68-46-41(65)38(62)35(59)29(20-56)71-46/h9,24-49,55-67H,10-22H2,1-8H3/b23-9-/t24-,25-,26+,27+,28?,29+,30+,31-,32-,33-,34-,35+,36+,37+,38-,39-,40+,41+,42+,43+,44-,45+,46+,47-,48-,49-,51+,52-,53+,54-/m0/s1",C/C(=C/CC(O)[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5O[C@H](C)[C@H](O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C)CO,C54H90O21,pos_3_3sodium,1074.5974599,ZVQYCHMNZFFTTA,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum squarrosum,451574.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum squarrosum'],6,0,6.0 2743,5550,-1,,,,0.0,MS1_match,RJFWJLUXDOXVBF-UHFFFAOYSA-N,"InChI=1S/C54H90O21/c1-23(20-68-47-42(65)39(62)36(59)30(73-47)21-69-46-41(64)37(60)34(57)25(3)70-46)9-10-28(56)24(2)27-13-15-52(8)32-12-11-31-50(5,6)33(14-16-53(31)22-54(32,53)18-17-51(27,52)7)74-48-44(67)40(63)45(26(4)71-48)75-49-43(66)38(61)35(58)29(19-55)72-49/h9,24-49,55-67H,10-22H2,1-8H3",CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(C)C(OC5OC(C)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC45CC35CCC12C)COC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O,C54H90O21,pos_3_3sodium,1074.5974599,RJFWJLUXDOXVBF,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum fortunei,5728049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fortunei'],6,0,6.0 2744,5548,-1,,,,0.63451654,ISDB,LFZKYFUJTHRDRN-JXIMHRGCSA-N,"InChI=1S/C21H32O3/c1-18-8-5-15-19(2)9-7-16(22)20(3,17(23)24-4)14(19)6-10-21(15,13-18)12-11-18/h11-12,14-16,22H,5-10,13H2,1-4H3/t14-,15-,16+,18+,19+,20-,21-/m0/s1",COC(=O)[C@]1(C)[C@H](O)CC[C@@]2(C)[C@@H]3CC[C@]4(C)C=C[C@@]3(CC[C@@H]21)C4,C21H32O3,,332.235144884,LFZKYFUJTHRDRN,Terpenoids,Diterpenoids,Beyerane diterpenoids,Polycalymma stuartii,1076957.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Polycalymma'],['Polycalymma stuartii'],4,0,6.538066148757935 2745,5546,-1,,,,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton1acetonitrile,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 2746,5545,1027,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-γ)",0.30418837,ISDB,UIUSQYGQZRBKCC-NHWXEJKLSA-N,"InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-26,36-37,41H,5,27-29H2,1-4,6-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+/t36-,37+/m1/s1",C=C1C=CCC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C,C40H54O,,550.417466348,UIUSQYGQZRBKCC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-γ)",Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,3,6.7167534828186035 2747,5541,-1,,,,0.390756,ISDB,WJCBCORBKKAWBG-ZTYVBPEOSA-N,"InChI=1S/C19H30O10/c1-9(2)10-4-5-19(3,26)12(6-10)29-18-17(25)16(24)15(23)11(28-18)8-27-14(22)7-13(20)21/h6,9,11-12,15-18,23-26H,4-5,7-8H2,1-3H3,(H,20,21)/t11-,12+,15-,16-,17-,18+,19-/m1/s1",CC(C)C1=C[C@H](O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@@H](O)[C@H]2O)[C@](C)(O)CC1,C19H30O10,,418.18389716,WJCBCORBKKAWBG,Terpenoids,Monoterpenoids,,Monarda punctata,514020.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Monarda'],['Monarda punctata'],4,0,5.563024044036865 2748,5540,-1,,,,0.29296005,ISDB,WDNYAORDIIYQKT-DEJUDLAWSA-N,"InChI=1S/C25H40O12/c1-11-7-13(27)8-25(3,4)14(11)6-5-12(2)35-24-22(33)20(31)18(29)16(37-24)10-34-23-21(32)19(30)17(28)15(9-26)36-23/h5-7,12,14-24,26,28-33H,8-10H2,1-4H3/b6-5+/t12-,14+,15-,16-,17+,18-,19+,20+,21-,22-,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O12,,532.25197672,WDNYAORDIIYQKT,Terpenoids,Apocarotenoids,Megastigmanes,Macaranga tanarius,573156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Macaranga'],['Macaranga tanarius'],4,0,5.171840190887451 2749,5539,957,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.29040155,ISDB,JLIUTAYKPGJIKJ-UHFFFAOYSA-N,"InChI=1S/C25H40O13/c1-11(36-24-22(34)20(32)18(30)16(9-27)38-24)4-5-14-12(6-13(28)7-25(14,2)3)10-35-23-21(33)19(31)17(29)15(8-26)37-23/h4-6,11,14-24,26-27,29-34H,7-10H2,1-3H3",CC(C=CC1C(COC2OC(CO)C(O)C(O)C2O)=CC(=O)CC1(C)C)OC1OC(CO)C(O)C(O)C1O,C25H40O13,,548.24689134,JLIUTAYKPGJIKJ,Terpenoids,Apocarotenoids,Megastigmanes,Hydrangea serrata,584050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea serrata'],4,1,5.661606192588806 2750,5539,957,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.29040155,ISDB,JLIUTAYKPGJIKJ-VWQLHZPCSA-N,"InChI=1S/C25H40O13/c1-11(36-24-22(34)20(32)18(30)16(9-27)38-24)4-5-14-12(6-13(28)7-25(14,2)3)10-35-23-21(33)19(31)17(29)15(8-26)37-23/h4-6,11,14-24,26-27,29-34H,7-10H2,1-3H3/b5-4+/t11-,14+,15-,16-,17-,18-,19+,20+,21-,22-,23-,24-/m1/s1",C[C@H](/C=C/[C@H]1C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(=O)CC1(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C25H40O13,,548.24689134,JLIUTAYKPGJIKJ,Terpenoids,Apocarotenoids,Megastigmanes,Hydrangea macrophylla,162001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea macrophylla'],4,1,5.661606192588806 2751,5537,-1,,,,0.0,MS1_match,VTCDZPUMZAZMSB-UHFFFAOYSA-N,"InChI=1S/C9H12O4/c1-11-7-4-6(10)5-8(12-2)9(7)13-3/h4-5,10H,1-3H3",COc1cc(O)cc(OC)c1OC,C9H12O4,pos_2MHNH3,184.073558864,VTCDZPUMZAZMSB,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 2752,5536,849,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,0.20643505,ISDB,,,,,,,AAXHHISTDMILPL,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8257402181625366 2753,5534,903,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.39198747,ISDB,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,10.067949891090393 2754,5533,-1,,,,0.0,MS1_match,CVLKSGMETVVYCI-KEOMQFIYSA-N,"InChI=1S/C28H32O16/c1-37-15-7-11-3-5-13(15)41-27-23(33)21(31)19(29)17(43-27)10-40-26(36)12-4-6-14(16(8-12)38-2)42-28-24(34)22(32)20(30)18(44-28)9-39-25(11)35/h3-8,17-24,27-34H,9-10H2,1-2H3/t17-,18-,19-,20-,21-,22+,23-,24-,27-,28-/m1/s1",COc1cc2ccc1O[C@@H]1O[C@H](COC(=O)c3ccc(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C28H32O16,pos_1_1proton1ammonium,624.169034944,CVLKSGMETVVYCI,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 2755,5533,-1,,,,0.0,MS1_match,CVLKSGMETVVYCI-KEOMQFIYSA-N,"InChI=1S/C28H32O16/c1-37-15-7-11-3-5-13(15)41-27-23(33)21(31)19(29)17(43-27)10-40-26(36)12-4-6-14(16(8-12)38-2)42-28-24(34)22(32)20(30)18(44-28)9-39-25(11)35/h3-8,17-24,27-34H,9-10H2,1-2H3/t17-,18-,19-,20-,21-,22+,23-,24-,27-,28-/m1/s1",COc1cc2ccc1O[C@@H]1O[C@H](COC(=O)c3ccc(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C28H32O16,pos_1_1proton1ammonium,624.169034944,CVLKSGMETVVYCI,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 2756,5532,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.69629216,ISDB,,,,,,,ZOGNWEIKQILIRK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.7851686477661133 2757,5528,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.5727112,ISDB,CWFCNWIAOJWEMI-UHFFFAOYSA-N,"InChI=1S/C20H29NO4/c1-6-19(4,21)18(23)25-17-14-11(2)10-24-16(14)15(22)13-9-7-8-12(3)20(13,17)5/h10,12-13,17H,6-9,21H2,1-5H3",CCC(C)(N)C(=O)OC1c2c(C)coc2C(=O)C2CCCC(C)C21C,C20H29NO4,,347.209658408,CWFCNWIAOJWEMI,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Pittocaulon velatum,5794280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Pittocaulon'],['Pittocaulon velatum'],4,1,6.790844917297363 2758,5526,-1,,,,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_sodium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2759,5526,-1,,,,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_sodium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2760,5526,-1,,,,0.0,MS1_match,NFIQKUQYFSTGFU-VWZQPUASSA-N,"InChI=1S/C47H76O17/c1-42(2)14-16-47(41(58)64-40-37(57)34(54)32(52)26(62-40)21-60-38-36(56)33(53)31(51)25(19-48)61-38)17-15-45(6)22(23(47)18-42)8-9-28-44(5)12-11-29(43(3,4)27(44)10-13-46(28,45)7)63-39-35(55)30(50)24(49)20-59-39/h8,23-40,48-57H,9-21H2,1-7H3/t23-,24-,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38+,39-,40-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O17,pos_1_sodium,912.5082509720002,NFIQKUQYFSTGFU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 2761,5525,-1,,,,0.6645255,ISDB,,,,,,,YYYZPJRIBDBWJH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.658102035522461 2762,5524,-1,,,,0.0,MS1_match,IXJHFORJGDOBHK-IFNLGUEUSA-N,"InChI=1S/C26H28O12/c1-3-10(2)26(35)38-25-22(34)21(33)18(9-27)37-24(25)20-15(31)7-14(30)19-16(32)8-17(36-23(19)20)11-4-5-12(28)13(29)6-11/h4-8,10,18,21-22,24-25,27-31,33-34H,3,9H2,1-2H3/t10-,18-,21-,22+,24+,25-/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc12,C26H28O12,pos_1_1proton1ammonium,532.158076336,IXJHFORJGDOBHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2763,5524,-1,,,,0.0,MS1_match,IXJHFORJGDOBHK-IFNLGUEUSA-N,"InChI=1S/C26H28O12/c1-3-10(2)26(35)38-25-22(34)21(33)18(9-27)37-24(25)20-15(31)7-14(30)19-16(32)8-17(36-23(19)20)11-4-5-12(28)13(29)6-11/h4-8,10,18,21-22,24-25,27-31,33-34H,3,9H2,1-2H3/t10-,18-,21-,22+,24+,25-/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc12,C26H28O12,pos_1_1proton1ammonium,532.158076336,IXJHFORJGDOBHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2764,5523,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2431076,ISDB,WRYJYFCCMSVEPQ-MNIDVGFKSA-N,"InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21-,24-,25-,26-,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,38+,39+,40-,41-,42-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H68O13,,780.4659922360001,WRYJYFCCMSVEPQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clinopodium micranthum,453485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Clinopodium'],['Clinopodium micranthum'],4,3,6.472430408000946 2765,5523,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2431076,ISDB,WRYJYFCCMSVEPQ-ORAXXRKOSA-N,"InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21-,24-,25-,26-,27-,28+,29+,30-,31+,32-,33-,34+,35+,36+,38+,39+,40-,41-,42-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H68O13,,780.4659922360001,WRYJYFCCMSVEPQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum falcatum,892026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum falcatum'],4,3,6.472430408000946 2766,5523,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2431076,ISDB,WRYJYFCCMSVEPQ-MNIDVGFKSA-N,"InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21-,24-,25-,26-,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,38+,39+,40-,41-,42-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H68O13,,780.4659922360001,WRYJYFCCMSVEPQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum smithii,820033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum smithii'],4,3,6.472430408000946 2767,5523,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2431076,ISDB,WRYJYFCCMSVEPQ-UHFFFAOYSA-N,"InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3",CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC3=C5CC(C)(C)CCC5(CO)C(O)CC34C)C2(C)CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O,C42H68O13,,780.4659922360001,WRYJYFCCMSVEPQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum smithii var. parvifolium,657161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum smithii'],4,3,6.472430408000946 2768,5523,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2431076,ISDB,WRYJYFCCMSVEPQ-MNIDVGFKSA-N,"InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21-,24-,25-,26-,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,38+,39+,40-,41-,42-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C42H68O13,,780.4659922360001,WRYJYFCCMSVEPQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum chinense,486734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum chinense'],4,3,6.472430408000946 2769,5522,-1,,,,0.0,MS1_match,WGTYXIDAEFJHPD-DJSGBOIRSA-N,"InChI=1S/C25H32O11/c1-33-17-9-13(4-5-16(17)29)23-15(10-27)14-7-12(3-2-6-26)8-18(24(14)36-23)34-25-22(32)21(31)20(30)19(11-28)35-25/h4-5,7-9,15,19-23,25-32H,2-3,6,10-11H2,1H3/t15-,19+,20+,21-,22+,23+,25+/m0/s1",COc1cc([C@H]2Oc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(CCCO)cc3[C@@H]2CO)ccc1O,C25H32O11,pos_1_1proton,508.1944618439998,WGTYXIDAEFJHPD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 2770,5522,-1,,,,0.0,MS1_match,WGTYXIDAEFJHPD-DJSGBOIRSA-N,"InChI=1S/C25H32O11/c1-33-17-9-13(4-5-16(17)29)23-15(10-27)14-7-12(3-2-6-26)8-18(24(14)36-23)34-25-22(32)21(31)20(30)19(11-28)35-25/h4-5,7-9,15,19-23,25-32H,2-3,6,10-11H2,1H3/t15-,19+,20+,21-,22+,23+,25+/m0/s1",COc1cc([C@H]2Oc3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(CCCO)cc3[C@@H]2CO)ccc1O,C25H32O11,pos_1_1proton,508.1944618439998,WGTYXIDAEFJHPD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 2771,5520,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.4135684,ISDB,,,,,,,OQLJKOCUPPXSDK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6542736291885376 2772,5518,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1proton,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 2773,5518,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1proton,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 2774,5516,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.3246846,ISDB,,,,,,,HFVDXGMRYRRPLH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2987383604049683 2775,5512,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.25762317,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,9.530492663383484 2776,5512,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.25762317,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,9.530492663383484 2777,5511,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29547697,ISDB,UAUUFLADFXKYAU-UHFFFAOYSA-N,"InChI=1S/C36H58O8/c1-20-27(40)28(41)29(42)30(43-20)44-26-11-12-32(4)23(33(26,5)18-37)10-13-34(6)24(32)9-8-21-22-16-31(2,3)14-15-36(22,19-38)25(39)17-35(21,34)7/h8-9,20,23-30,37-42H,10-19H2,1-7H3",CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC3=C5CC(C)(C)CCC5(CO)C(O)CC34C)C2(C)CO)C(O)C(O)C1O,C36H58O8,,618.413168816,UAUUFLADFXKYAU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum smithii var. parvifolium,657161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum smithii'],4,3,6.681907892227173 2778,5511,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29547697,ISDB,UAUUFLADFXKYAU-AKICHWIXSA-N,"InChI=1S/C36H58O8/c1-20-27(40)28(41)29(42)30(43-20)44-26-11-12-32(4)23(33(26,5)18-37)10-13-34(6)24(32)9-8-21-22-16-31(2,3)14-15-36(22,19-38)25(39)17-35(21,34)7/h8-9,20,23-30,37-42H,10-19H2,1-7H3/t20-,23-,24-,25+,26+,27+,28+,29-,30+,32+,33+,34-,35-,36-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O)[C@H]1O,C36H58O8,,618.413168816,UAUUFLADFXKYAU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum smithii,820033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum smithii'],4,3,6.681907892227173 2779,5511,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29547697,ISDB,UAUUFLADFXKYAU-WQPKRVEVSA-N,"InChI=1S/C36H58O8/c1-20-27(40)28(41)29(42)30(43-20)44-26-11-12-32(4)23(33(26,5)18-37)10-13-34(6)24(32)9-8-21-22-16-31(2,3)14-15-36(22,19-38)25(39)17-35(21,34)7/h8-9,20,23-30,37-42H,10-19H2,1-7H3/t20-,23-,24-,25-,26+,27+,28+,29-,30+,32+,33+,34-,35-,36-/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C=CC3=C5CC(C)(C)CC[C@]5(CO)[C@H](O)C[C@]34C)[C@]2(C)CO)[C@H](O)[C@@H](O)[C@H]1O,C36H58O8,,618.413168816,UAUUFLADFXKYAU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum chinense,486734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum chinense'],4,3,6.681907892227173 2780,5510,-1,,,,0.692486,ISDB,MXDYUQKBEOVZSA-DMLGPZFASA-N,"InChI=1S/C15H22O6S/c1-8-3-4-11(16)15(2)6-5-9-10(7-22(18,19)20)14(17)21-13(9)12(8)15/h3,9-13,16H,4-7H2,1-2H3,(H,18,19,20)/t9-,10-,11+,12+,13-,15-/m0/s1",CC1=CC[C@@H](O)[C@]2(C)CC[C@@H]3[C@H](OC(=O)[C@H]3CS(=O)(=O)O)[C@@H]12,C15H22O6S,,330.113709424,MXDYUQKBEOVZSA,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Aucklandia lappa,772548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea costus'],4,0,6.769943952560425 2781,5510,-1,,,,0.692486,ISDB,MXDYUQKBEOVZSA-DMLGPZFASA-N,"InChI=1S/C15H22O6S/c1-8-3-4-11(16)15(2)6-5-9-10(7-22(18,19)20)14(17)21-13(9)12(8)15/h3,9-13,16H,4-7H2,1-2H3,(H,18,19,20)/t9-,10-,11+,12+,13-,15-/m0/s1",CC1=CC[C@@H](O)[C@]2(C)CC[C@@H]3[C@H](OC(=O)[C@H]3CS(=O)(=O)O)[C@@H]12,C15H22O6S,,330.113709424,MXDYUQKBEOVZSA,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Aucklandia costus,772548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea costus'],4,0,6.769943952560425 2782,5510,-1,,,,0.692486,ISDB,MXDYUQKBEOVZSA-DMLGPZFASA-N,"InChI=1S/C15H22O6S/c1-8-3-4-11(16)15(2)6-5-9-10(7-22(18,19)20)14(17)21-13(9)12(8)15/h3,9-13,16H,4-7H2,1-2H3,(H,18,19,20)/t9-,10-,11+,12+,13-,15-/m0/s1",CC1=CC[C@@H](O)[C@]2(C)CC[C@@H]3[C@H](OC(=O)[C@H]3CS(=O)(=O)O)[C@@H]12,C15H22O6S,,330.113709424,MXDYUQKBEOVZSA,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Saussurea costus,772548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea costus'],4,0,6.769943952560425 2783,5506,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CPYDMLXRLHYXSV-UNKAVFLYSA-N,"InChI=1S/C18H22O9/c1-25-13-7-10(3-5-11(13)19)4-6-15(21)27-14-9-18(24,17(23)26-2)8-12(20)16(14)22/h3-7,12,14,16,19-20,22,24H,8-9H2,1-2H3/b6-4+/t12-,14-,16-,18+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(OC)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,CPYDMLXRLHYXSV,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 2784,5506,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,HPJJCRNQEWRFQW-ILXVDBEPSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(14(22)9-18)27-15(23)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-22,25H,2,8-9H2,1H3/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,HPJJCRNQEWRFQW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 2785,5506,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 2786,5506,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 2787,5505,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.2615232,ISDB,KPVAJIDSYFXVKV-YKTCQIRHSA-N,"InChI=1S/C23H31NO5S/c1-18(2)16-21(25)17-19(3)11-14-29-22-8-6-20(7-9-22)10-13-24(4)23(26)12-15-30(5,27)28/h6-9,12,15-17H,10-11,13-14H2,1-5H3/b15-12+,19-17+",CC(C)=CC(=O)/C=C(\C)CCOc1ccc(CCN(C)C(=O)/C=C/S(C)(=O)=O)cc1,C23H31NO5S,,433.192294092,KPVAJIDSYFXVKV,Alkaloids,,,Glycosmis angustifolia,6125986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Glycosmis'],['Glycosmis angustifolia'],4,1,5.546092748641968 2788,5504,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,WYDGCJLTZZIEHA-UHFFFAOYSA-N,"InChI=1S/C24H35NO4/c1-5-25-11-22(4)8-7-17(27)24-16(22)10-15(20(24)25)23-9-6-14(12(2)21(23)28)18(19(23)24)29-13(3)26/h14-21,27-28H,2,5-11H2,1,3-4H3",C=C1C2CCC3(C1O)C1CC4C5(C)CCC(O)C4(C1N(CC)C5)C3C2OC(C)=O,C24H35NO4,pos_2_2proton1acetonitrile,401.2566086,WYDGCJLTZZIEHA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kirinense,5737821.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kirinense'],6,3,7.5 2789,5504,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,WYDGCJLTZZIEHA-RGBYBVADSA-N,"InChI=1S/C24H35NO4/c1-5-25-11-22(4)8-7-17(27)24-16(22)10-15(20(24)25)23-9-6-14(12(2)21(23)28)18(19(23)24)29-13(3)26/h14-21,27-28H,2,5-11H2,1,3-4H3/t14-,15+,16-,17+,18+,19-,20-,21-,22+,23+,24-/m1/s1",C=C1[C@H]2CC[C@@]3([C@@H]1O)[C@@H]([C@H]2OC(C)=O)[C@]12[C@@H]4C[C@H]3[C@H]1N(CC)C[C@]4(C)CC[C@@H]2O,C24H35NO4,pos_2_2proton1acetonitrile,401.2566086,WYDGCJLTZZIEHA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum leucostomum,723178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum leucostomum'],6,3,7.5 2790,5504,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,WYDGCJLTZZIEHA-RGBYBVADSA-N,"InChI=1S/C24H35NO4/c1-5-25-11-22(4)8-7-17(27)24-16(22)10-15(20(24)25)23-9-6-14(12(2)21(23)28)18(19(23)24)29-13(3)26/h14-21,27-28H,2,5-11H2,1,3-4H3/t14-,15+,16-,17+,18+,19-,20-,21-,22+,23+,24-/m1/s1",C=C1[C@H]2CC[C@@]3([C@@H]1O)[C@@H]([C@H]2OC(C)=O)[C@]12[C@@H]4C[C@H]3[C@H]1N(CC)C[C@]4(C)CC[C@@H]2O,C24H35NO4,pos_2_2proton1acetonitrile,401.2566086,WYDGCJLTZZIEHA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,3,7.5 2791,5504,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,TWQHLFQYABYIGZ-SECHHAMBSA-N,"InChI=1S/C24H35NO4/c1-5-25-11-22(4)8-7-17(27)24-16(22)10-15(20(24)25)23-9-6-14(18(28)19(23)24)12(2)21(23)29-13(3)26/h14-21,27-28H,2,5-11H2,1,3-4H3/t14-,15?,16-,17+,18+,19-,20?,21-,22+,23+,24-/m1/s1",C=C1[C@H]2CC[C@@]3(C4C[C@@H]5[C@@]6(C)CC[C@H](O)[C@@]5(C4N(CC)C6)[C@@H]3[C@H]2O)[C@@H]1OC(C)=O,C24H35NO4,pos_2_2proton1acetonitrile,401.2566086,TWQHLFQYABYIGZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kirinense,5737821.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kirinense'],6,3,7.5 2792,5503,-1,,,,0.0,MS1_match,UTUISHMYVAZILQ-UHFFFAOYSA-N,"InChI=1S/C30H26O12/c31-14-24-29(42-25(36)10-3-15-1-6-17(32)7-2-15)27(37)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2",O=C(C=Cc1ccc(O)cc1)OC1C(CO)OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)C(O)C1O,C30H26O12,pos_1_sodium,578.142426272,UTUISHMYVAZILQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],9,0,9.0 2793,5501,-1,,,,0.55825436,ISDB,UPSIQTAGSPSMDI-LMDMKTBVSA-N,"InChI=1S/C24H24O11/c25-12-18-21(31)22(32)23(34-19(29)10-5-14-3-8-16(27)17(28)11-14)24(33-18)35-20(30)9-4-13-1-6-15(26)7-2-13/h1-11,18,21-28,31-32H,12H2/b9-4+,10-5+/t18-,21-,22+,23-,24+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1,C24H24O11,,488.131861588,UPSIQTAGSPSMDI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Balanophora japonica,223380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Santalales'],['Balanophoraceae'],['Unknown'],['Balanophora'],['Balanophora japonica'],4,0,6.233017444610596 2794,5498,449,Shikimates and Phenylpropanoids,Cyclic polyketides,Cinnamic acids and derivatives,0.46939877,ISDB,PFHBQBOWTMLEJD-MRVPVSSYSA-N,"InChI=1S/C11H16O2/c1-4-8(3)10-7-6-9(5-2)11(12)13-10/h6-8H,4-5H2,1-3H3/t8-/m1/s1",CCc1ccc([C@H](C)CC)oc1=O,C11H16O2,,180.115029752,PFHBQBOWTMLEJD,Polyketides,Cyclic polyketides,2-pyrone derivatives,Nocardiopsis,176964.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptosporangiales'],['Nocardiopsaceae'],['Unknown'],['Nocardiopsis'],['Unknown'],0,2,2.877595067024231 2795,5496,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.54232216,ISDB,TXPPGEHBRJWGMZ-APACUCGBSA-N,"InChI=1S/C16H24O7/c1-8-5-4-6-16(2,3)10(8)14(21)23-15-13(20)12(19)11(18)9(7-17)22-15/h4-5,9,11-13,15,17-20H,6-7H2,1-3H3/t9-,11-,12+,13-,15+/m1/s1",CC1=C(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)CC=C1,C16H24O7,,328.152203108,TXPPGEHBRJWGMZ,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Gardenia jasminoides,919367.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Gardenieae'],['Gardenia'],['Gardenia jasminoides'],4,2,7.169288635253906 2796,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 2797,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 2798,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 2799,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 2800,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 2801,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 2802,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 2803,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 2804,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 2805,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 2806,5495,198,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 2807,5493,236,,,,0.2713283,ISDB,,,,,,,VJVDYBXGAPKGPU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0853132009506226 2808,5491,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_2_2proton2acetonitrile,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 2809,5491,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_2_2proton2acetonitrile,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 2810,5489,-1,,,,0.0,MS1_match,YDDGKXBLOXEEMN-XAKUNQSDSA-N,"InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O,C22H18O12,pos_1_1proton1acetonitrile,474.0798260159999,YDDGKXBLOXEEMN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 2811,5489,-1,,,,0.0,MS1_match,YDDGKXBLOXEEMN-XAKUNQSDSA-N,"InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O,C22H18O12,pos_1_1proton1acetonitrile,474.0798260159999,YDDGKXBLOXEEMN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 2812,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,2,7.0 2813,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,2,7.0 2814,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana condamoana,6061611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana condamoana'],6,2,7.0 2815,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 2816,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 2817,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 2818,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,2,7.0 2819,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,2,7.0 2820,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,2,7.0 2821,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,2,7.0 2822,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,2,7.0 2823,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,2,7.0 2824,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,2,7.0 2825,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,2,7.0 2826,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,2,7.0 2827,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,2,7.0 2828,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,2,7.0 2829,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,2,7.0 2830,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,2,7.0 2831,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,2,7.0 2832,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,2,7.0 2833,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,2,7.0 2834,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,2,7.0 2835,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,2,7.0 2836,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,2,7.0 2837,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,2,7.0 2838,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,2,7.0 2839,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,2,7.0 2840,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,2,7.0 2841,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,2,7.0 2842,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 2843,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,2,7.0 2844,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,2,7.0 2845,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 2846,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,2,7.0 2847,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 2848,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,VSUJAXGURPSNJL-UHFFFAOYSA-N,"InChI=1S/C24H32O10/c1-12(2)7-19(27)33-18-8-17-16(9-29-14(5)25)10-30-23(20(17)24(18)11-31-24)34-22(28)21(13(3)4)32-15(6)26/h8,10,12-13,18,20-21,23H,7,9,11H2,1-6H3",CC(=O)OCC1=COC(OC(=O)C(OC(C)=O)C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C24H32O10,pos_2_2proton,480.199547224,VSUJAXGURPSNJL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 2849,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,2,7.0 2850,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,2,7.0 2851,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 2852,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,2,7.0 2853,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,2,7.0 2854,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,2,7.0 2855,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,2,7.0 2856,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,2,7.0 2857,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana condamoana,6061611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana condamoana'],6,2,7.0 2858,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 2859,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 2860,5488,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_2_2proton,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 2861,5487,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,SFJFCIDQFBVZLY-UHFFFAOYSA-N,"InChI=1S/C20H34O2/c1-17(2)8-4-9-20(13-21)15(17)7-10-19-11-14(5-6-16(19)20)18(3,22)12-19/h14-16,21-22H,4-13H2,1-3H3",CC1(C)CCCC2(CO)C1CCC13CC(CCC12)C(C)(O)C3,C20H34O2,pos_1_1proton1acetonitrile,306.255880328,SFJFCIDQFBVZLY,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aconitum coreanum,377294.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum coreanum'],6,2,7.0 2862,5485,-1,,,,0.0,MS1_match,HGIHDUILBYERQC-CQSZACIVSA-N,"InChI=1S/C14H20O5/c1-9(2)13(17)19-8-14(18,7-15)11-5-4-10(3)6-12(11)16/h4-6,9,15-16,18H,7-8H2,1-3H3/t14-/m1/s1",Cc1ccc([C@@](O)(CO)COC(=O)C(C)C)c(O)c1,C14H20O5,pos_1_1proton1ammonium,268.13107374,HGIHDUILBYERQC,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 2863,5483,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.20558964,ISDB,,,,,,,QZBAPOXIHSUTHJ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8223585486412048 2864,5481,-1,,,,0.0,MS1_match,ZNJFBWYDHIGLCU-HWKXXFMVSA-N,"InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3-/t9-,10-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O,C12H18O3,pos_1_1proton1methanol,210.125594436,ZNJFBWYDHIGLCU,Fatty acids,Octadecanoids,Jasmonic acids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 2865,5480,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.29357842,ISDB,MLGXROJIIPYZRU-UHFFFAOYSA-N,"InChI=1S/C25H33NO12/c1-3-15-16(5-4-13-8-14(22(32)33)10-26(9-13)6-7-27)17(23(34)35-2)12-36-24(15)38-25-21(31)20(30)19(29)18(11-28)37-25/h3-5,8,10,12,15-16,18-21,24-25,27-31H,1,6-7,9,11H2,2H3,(H,32,33)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=CN(CCO)C1,C25H33NO12,,539.200275496,MLGXROJIIPYZRU,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],0,2,2.1743136644363403 2866,5479,66,Shikimates and Phenylpropanoids,Chromanes,Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_sodium,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 2867,5479,66,Shikimates and Phenylpropanoids,Chromanes,Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_sodium,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 2868,5479,66,Shikimates and Phenylpropanoids,Chromanes,Chromones,0.0,MS1_match,PBHOYFHVNTVOLB-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(8-30-21-19(29)18(28)17(27)15(7-23)32-21)2-3-11-12(24)5-14(26)16-13(25)4-10(6-22)31-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O11,pos_1_sodium,454.147511652,PBHOYFHVNTVOLB,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 2869,5479,66,Shikimates and Phenylpropanoids,Chromanes,Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_sodium,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,3,7.5 2870,5479,66,Shikimates and Phenylpropanoids,Chromanes,Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_sodium,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 2871,5477,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.2089589,ISDB,MANRNIGLLXPOCY-UHFFFAOYSA-N,"InChI=1S/C24H37NO5/c1-4-5-6-7-8-11-14-20-21(29-20)15-12-9-10-13-18(26)16-22(27)25-19-17-24(2,3)30-23(19)28/h9-10,12-13,17-18,20-21,26H,4-8,11,14-16H2,1-3H3,(H,25,27)",CCCCCCCCC1OC1CC=CC=CC(O)CC(=O)NC1=CC(C)(C)OC1=O,C24H37NO5,,419.267173284,MANRNIGLLXPOCY,Polyketides,,,Pseudoalteromonas,388487.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Gammaproteobacteria'],['Alteromonadales'],['Pseudoalteromonadaceae'],['Unknown'],['Pseudoalteromonas'],['Unknown'],0,0,0.8358355760574341 2872,5476,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.21672335,ISDB,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,10.366893410682678 2873,5476,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.21672335,ISDB,UEHILKCNLIKLEV-FMYTYVRISA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26+,27+,28+,29+,30+,31-,32-,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@@H](O)[C@@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,10.366893410682678 2874,5476,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.21672335,ISDB,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,3,10.366893410682678 2875,5475,-1,,,,0.0,MS1_match,HKEAFJYKMMKDOR-VPRICQMDSA-N,"InChI=1S/C21H20O9/c22-7-14-17(26)18(27)19(28)21(30-14)15-13(24)6-5-11-16(25)12(8-29-20(11)15)9-1-3-10(23)4-2-9/h1-6,8,14,17-19,21-24,26-28H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1c(-c2ccc(O)cc2)coc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc12,C21H20O9,pos_1_sodium,416.1107322199998,HKEAFJYKMMKDOR,Shikimates and Phenylpropanoids,Isoflavonoids,Isoflavones,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 2876,5475,-1,,,,0.0,MS1_match,HKEAFJYKMMKDOR-VPRICQMDSA-N,"InChI=1S/C21H20O9/c22-7-14-17(26)18(27)19(28)21(30-14)15-13(24)6-5-11-16(25)12(8-29-20(11)15)9-1-3-10(23)4-2-9/h1-6,8,14,17-19,21-24,26-28H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1c(-c2ccc(O)cc2)coc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)ccc12,C21H20O9,pos_1_sodium,416.1107322199998,HKEAFJYKMMKDOR,Shikimates and Phenylpropanoids,Isoflavonoids,Isoflavones,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 2877,5470,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.23178007,ISDB,XZVWVQIWDKJIQE-FOIFJWKZSA-N,"InChI=1S/C23H48NO6P/c1-20(2)14-12-10-8-7-9-11-13-15-21(3)23(26)29-18-22(25)19-30-31(27,28)17-16-24(4,5)6/h20-22,25H,7-19H2,1-6H3/t21?,22-/m1/s1",CC(C)CCCCCCCCCC(C)C(=O)OC[C@@H](O)COP(=O)([O-])CC[N+](C)(C)C,C23H48NO6P,,465.321924886,XZVWVQIWDKJIQE,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Stelletta,662723.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Tetractinellida'],['Ancorinidae'],['Unknown'],['Stelletta'],['Unknown'],1,0,1.9271202683448792 2878,5469,-1,,,,0.0,MS1_match,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,pos_1_1proton1methanol,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,0,6.0 2879,5469,-1,,,,0.0,MS1_match,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,pos_1_1proton1methanol,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 2880,5469,-1,,,,0.0,MS1_match,FBBKXUQEUJYJAW-LXUWXYTASA-N,"InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)OC[C@H](O)[C@@H]1O,C35H34O19,pos_1_1proton1methanol,758.1694288680003,FBBKXUQEUJYJAW,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 2881,5466,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,RFTKPXQZIVKVOP-PMQCXRHVSA-N,"InChI=1S/C16H20O9/c1-23-10-4-2-8(6-9(10)18)3-5-12(19)25-16-15(22)14(21)13(20)11(7-17)24-16/h2-6,11,13-18,20-22H,7H2,1H3/b5-3+/t11-,13-,14+,15-,16+/m1/s1",COc1ccc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C16H20O9,pos_1_sodium,356.11073222,RFTKPXQZIVKVOP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,3,7.5 2882,5462,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BNZPSEZCTSCFIK-ACOAUPBPSA-N,"InChI=1S/C36H43NO9/c1-7-16(2)32(41)46-26-30(40)34(6)15-37-21-14-35-13-17(3)22-24(45-33(42)20-11-9-8-10-12-20)23(35)29(37)36(27(21)34,31(26)44-19(5)39)28(35)25(22)43-18(4)38/h8-12,16,21-31,40H,3,7,13-15H2,1-2,4-6H3/t16-,21-,22-,23+,24+,25-,26+,27+,28+,29+,30+,31+,34-,35-,36+/m1/s1",C=C1C[C@@]23C[C@@H]4[C@H]5[C@@]6(C)CN4[C@H]4[C@@H]2[C@@H](OC(=O)c2ccccc2)[C@@H]1[C@@H](OC(C)=O)[C@@H]3[C@]45[C@@H](OC(C)=O)[C@@H](OC(=O)[C@H](C)CC)[C@@H]6O,C36H43NO9,pos_1_1proton1ethylamine,633.293781956,BNZPSEZCTSCFIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,3,7.5 2883,5462,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,SUAGNMVLYLCPLQ-HZTMVZLDSA-N,"InChI=1S/C36H43NO9/c1-7-16(2)32(41)46-30-24(40)31(44-19(5)39)36-27-21-14-35-13-17(3)22(26(28(35)36)43-18(4)38)25(45-33(42)20-11-9-8-10-12-20)23(35)29(36)37(21)15-34(27,30)6/h8-12,16,21-31,40H,3,7,13-15H2,1-2,4-6H3/t16-,21+,22+,23-,24-,25-,26+,27-,28-,29-,30+,31+,34+,35+,36-/m0/s1",C=C1C[C@@]23C[C@@H]4[C@H]5[C@@]6(C)CN4[C@H]4[C@@H]2[C@@H](OC(=O)c2ccccc2)[C@@H]1[C@@H](OC(C)=O)[C@@H]3[C@]45[C@H](OC(C)=O)[C@@H](O)[C@H]6OC(=O)[C@@H](C)CC,C36H43NO9,pos_1_1proton1ethylamine,633.293781956,SUAGNMVLYLCPLQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,3,7.5 2884,5459,-1,,,,0.0,MS1_match,RTVFIUBAXAZKSU-UHFFFAOYSA-N,"InChI=1S/C22H19NO6/c1-23-8-14-20(18(25-3)7-19-22(14)29-10-28-19)13-6-15(24-2)11-4-16-17(27-9-26-16)5-12(11)21(13)23/h4-7H,8-10H2,1-3H3",COc1cc2c(c3c1-c1cc(OC)c4cc5c(cc4c1N(C)C3)OCO5)OCO2,C22H19NO6,pos_2_2proton1acetonitrile,393.121237328,RTVFIUBAXAZKSU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lucidum,977702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lucidum'],6,0,6.0 2885,5458,-1,,,,0.0,MS1_match,JGXFMIJHKASCIZ-LDBVRRDLSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1acetonitrile,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,0,6.0 2886,5458,-1,,,,0.0,MS1_match,JGXFMIJHKASCIZ-LQLJJDJVSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20+,21-,22+,23+/m0/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1acetonitrile,492.126776208,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,0,6.0 2887,5458,-1,,,,0.0,MS1_match,JGXFMIJHKASCIZ-LDBVRRDLSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1acetonitrile,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,0,6.0 2888,5458,-1,,,,0.0,MS1_match,JGXFMIJHKASCIZ-LQLJJDJVSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20+,21-,22+,23+/m0/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1acetonitrile,492.126776208,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,0,6.0 2889,5457,1219,Fatty acids,Fatty amides,N-acyl amines,0.3908602,ISDB,DKMGVACNAAKVRR-MRBSYODNSA-N,"InChI=1S/C25H37NO2/c1-2-3-4-5-6-7-8-9-10-11-15-19-24(27)20-16-21-25(28)26-22-23-17-13-12-14-18-23/h10-15,17-19H,2-9,16,20-22H2,1H3,(H,26,28)/b11-10+,19-15+",CCCCCCCCC/C=C/C=C/C(=O)CCCC(=O)NCc1ccccc1,C25H37NO2,,383.282429424,DKMGVACNAAKVRR,Fatty acids,Fatty amides,N-acyl amines,Lepidium meyenii,681784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Lepidieae'],['Lepidium'],['Lepidium meyenii'],4,3,7.063440799713135 2890,5454,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NFIQKUQYFSTGFU-VWZQPUASSA-N,"InChI=1S/C47H76O17/c1-42(2)14-16-47(41(58)64-40-37(57)34(54)32(52)26(62-40)21-60-38-36(56)33(53)31(51)25(19-48)61-38)17-15-45(6)22(23(47)18-42)8-9-28-44(5)12-11-29(43(3,4)27(44)10-13-46(28,45)7)63-39-35(55)30(50)24(49)20-59-39/h8,23-40,48-57H,9-21H2,1-7H3/t23-,24-,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38+,39-,40-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O17,pos_1_1proton,912.5082509720002,NFIQKUQYFSTGFU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2891,5454,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_1proton,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2892,5454,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_1proton,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 2893,5449,-1,,,,0.0,MS1_match,VVSLYQRZDNZIIV-HNNQEYCLSA-N,"InChI=1S/C21H26O12/c1-29-12-6-10(2-4-11(12)23)3-5-16(24)30-9-15-13(7-17(25)31-15)32-21-20(28)19(27)18(26)14(8-22)33-21/h2-6,13-15,18-23,26-28H,7-9H2,1H3/b5-3+/t13-,14+,15+,18+,19-,20+,21+/m0/s1",COc1cc(/C=C/C(=O)OC[C@H]2OC(=O)C[C@@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C21H26O12,pos_1_1proton1acetonitrile,470.142426272,VVSLYQRZDNZIIV,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 2894,5448,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton1ammonium,462.116211524,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 2895,5448,-1,,,,0.0,MS1_match,ULVBHEFDGPIWAT-BYXQHVMRSA-N,"InChI=1S/C22H22O11/c1-30-11-6-12(25)15-13(7-11)31-20(9-2-4-10(24)5-3-9)21(17(15)27)33-22-19(29)18(28)16(26)14(8-23)32-22/h2-7,14,16,18-19,22-26,28-29H,8H2,1H3/t14-,16-,18-,19-,22+/m1/s1",COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(-c3ccc(O)cc3)oc2c1,C22H22O11,pos_1_1proton1ammonium,462.1162115239998,ULVBHEFDGPIWAT,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Glaucidium palmatum,889044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Glaucidium'],['Glaucidium palmatum'],6,0,6.0 2896,5448,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1ammonium,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2897,5448,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1ammonium,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2898,5448,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1ammonium,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 2899,5448,-1,,,,0.0,MS1_match,NIILTAHMGPDJNM-GSMBFNAYSA-N,"InChI=1S/C22H22O11/c23-14-4-1-12(7-16(14)25)3-6-21(31)33-18(9-19(27)28)22(32,11-20(29)30)10-13-2-5-15(24)17(26)8-13/h1-8,18,23-26,32H,9-11H2,(H,27,28)(H,29,30)/b6-3+/t18-,22?/m1/s1",O=C(O)C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)(CC(=O)O)Cc1ccc(O)c(O)c1,C22H22O11,pos_1_1proton1ammonium,462.116211524,NIILTAHMGPDJNM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 2900,5448,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-SAEXZTQASA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5-/t19-,22-/m1/s1",COc1ccc(/C=C\C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2901,5448,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-SAEXZTQASA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5-/t19-,22-/m1/s1",COc1ccc(/C=C\C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 2902,5448,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-SAEXZTQASA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5-/t19-,22-/m1/s1",COc1ccc(/C=C\C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 2903,5448,-1,,,,0.0,MS1_match,ULVBHEFDGPIWAT-BYXQHVMRSA-N,"InChI=1S/C22H22O11/c1-30-11-6-12(25)15-13(7-11)31-20(9-2-4-10(24)5-3-9)21(17(15)27)33-22-19(29)18(28)16(26)14(8-23)32-22/h2-7,14,16,18-19,22-26,28-29H,8H2,1H3/t14-,16-,18-,19-,22+/m1/s1",COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(-c3ccc(O)cc3)oc2c1,C22H22O11,pos_1_1proton1ammonium,462.1162115239998,ULVBHEFDGPIWAT,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Glaucidium palmatum,889044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Glaucidium'],['Glaucidium palmatum'],6,0,6.0 2904,5448,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-AHKCGJDQSA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 2905,5448,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-GSVZXUNASA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3/t15-,17-,19+,20-,22+/m1/s1",COc1ccc(-c2cc(=O)c3c(O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1ammonium,462.1162115239998,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,0,6.0 2906,5448,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3",COc1ccc(-c2cc(=O)c3c(O)c(OC4OC(CO)C(O)C(O)C4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1ammonium,462.116211524,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,0,6.0 2907,5448,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-GSVZXUNASA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3/t15-,17-,19+,20-,22+/m1/s1",COc1ccc(-c2cc(=O)c3c(O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1ammonium,462.1162115239998,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,0,6.0 2908,5448,-1,,,,0.0,MS1_match,RMBWMWQXPGWZJZ-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-10-4-2-9(3-5-10)13-6-11(24)16-14(31-13)7-12(25)21(18(16)27)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-23,25-29H,8H2,1H3",COc1ccc(-c2cc(=O)c3c(O)c(OC4OC(CO)C(O)C(O)C4O)c(O)cc3o2)cc1,C22H22O11,pos_1_1proton1ammonium,462.116211524,RMBWMWQXPGWZJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,0,6.0 2909,5448,-1,,,,0.0,MS1_match,AZUURFWEIQDHCN-MZGJNUFDSA-N,"InChI=1S/C40H44O22/c1-14-25(46)29(50)31(52)38(55-14)56-17-10-20(45)24-21(11-17)57-33(16-7-8-18(43)19(44)9-16)35(28(24)49)61-40-36(30(51)26(47)22(12-41)59-40)62-39-32(53)34(27(48)23(13-42)58-39)60-37(54)15-5-3-2-4-6-15/h2-11,14,22-23,25-27,29-32,34,36,38-48,50-53H,12-13H2,1H3/t14-,22+,23+,25-,26+,27+,29+,30-,31+,32+,34-,36+,38+,39-,40-/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](OC(=O)c5ccccc5)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C40H44O22,pos_2_2proton2acetonitrile,876.232423048,AZUURFWEIQDHCN,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium carolinianum,529153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carolinianum'],6,0,6.0 2910,5448,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-PGPONNFDSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2911,5448,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton1ammonium,462.116211524,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 2912,5448,-1,,,,0.0,MS1_match,BRYZTZMVXZZLPD-PGPONNFDSA-N,"InChI=1S/C22H22O11/c1-31-14-6-12(27)16-11(26)5-13(8-2-3-9(24)10(25)4-8)32-21(16)17(14)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-25,27-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,BRYZTZMVXZZLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 2913,5448,-1,,,,0.0,MS1_match,YMPYAGUNPNITIL-AHKCGJDQSA-N,"InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5+/t19-,22-/m1/s1",COc1ccc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1OC,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,YMPYAGUNPNITIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 2914,5448,-1,,,,0.0,MS1_match,BTQPTWPZTSYUPW-AHKCGJDQSA-N,"InChI=1S/C22H22O11/c1-31-15-9-13(10-16(32-2)18(15)25)5-8-17(24)33-19(20(26)27)22(30,21(28)29)11-12-3-6-14(23)7-4-12/h3-10,19,23,25,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5+/t19-,22-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)cc2)C(=O)O)cc(OC)c1O,C22H22O11,pos_1_1proton1ammonium,462.1162115239999,BTQPTWPZTSYUPW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 2915,5447,-1,,,,0.8335157,ISDB,,,,,,,UDATXGSDHZXTEH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.3340628147125244 2916,5443,-1,,,,0.8148654,ISDB,,,,,,,ZMXMVOMPVVLKBY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.2594616413116455 2917,5440,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 2918,5440,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 2919,5440,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,PBHOYFHVNTVOLB-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(8-30-21-19(29)18(28)17(27)15(7-23)32-21)2-3-11-12(24)5-14(26)16-13(25)4-10(6-22)31-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,PBHOYFHVNTVOLB,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 2920,5440,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 2921,5440,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 2922,5434,-1,,,,0.0,MS1_match,IPRPPFIAVHPVJH-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2",O=CCc1ccc(O)cc1,C8H8O2,pos_1_1proton,136.052429496,IPRPPFIAVHPVJH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,0,8.0 2923,5433,-1,,,,0.42331576,ISDB,PQZFVGYQXOZIIR-DEVQJBAHSA-N,"InChI=1S/C16H17NOS/c18-16(17-12-6-3-7-13-17)11-5-2-1-4-9-15-10-8-14-19-15/h1-2,4-6,8-12,14H,3,7,13H2/b2-1+,9-4+,11-5+",O=C(/C=C/C=C/C=C/c1cccs1)N1C=CCCC1,C16H17NOS,,271.103085164,PQZFVGYQXOZIIR,,,,Otanthus maritimus,195139.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Otanthus'],['Otanthus maritimus'],4,0,5.693263053894043 2924,5432,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,SZQQHKQCCBDXCG-UHFFFAOYSA-N,"InChI=1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h10-15H,2-9H2,1H3,(H,17,18)",CCCCCCCCCC=CC=CC=CC(=O)O,C16H26O2,pos_1_1proton1acetonitrile,250.193280072,SZQQHKQCCBDXCG,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Ranunculus glacialis,225728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus glacialis'],6,0,6.0 2925,5430,-1,,,,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1potassium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 2926,5430,-1,,,,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1potassium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 2927,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-UHFFFAOYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3",COC(=O)CC(O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Dendrobium officinale,7046610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Malaxideae'],['Dendrobium'],['Dendrobium officinale'],4,3,7.373035907745361 2928,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-UHFFFAOYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3",COC(=O)CC(O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Dendrobium catenatum,171958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Malaxideae'],['Dendrobium'],['Dendrobium catenatum'],4,3,7.373035907745361 2929,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-UHFFFAOYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3",COC(=O)CC(O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Dendrobium moniliforme,171951.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Malaxideae'],['Dendrobium'],['Dendrobium moniliforme'],4,3,7.373035907745361 2930,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-UHFFFAOYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3",COC(=O)CC(O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Dendrobium huoshanense,293904.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Malaxideae'],['Dendrobium'],['Dendrobium huoshanense'],4,3,7.373035907745361 2931,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-SCSAIBSYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3/t4-/m1/s1",COC(=O)C[C@@H](O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Myrciaria dubia,256423.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Myrtaceae'],['Myrteae'],['Myrciaria'],['Myrciaria dubia'],4,3,7.373035907745361 2932,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-SCSAIBSYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3/t4-/m1/s1",COC(=O)C[C@@H](O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Oxalis pes-caprae,334044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Oxalidales'],['Oxalidaceae'],['Unknown'],['Oxalis'],['Oxalis pes-caprae'],4,3,7.373035907745361 2933,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-UHFFFAOYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3",COC(=O)CC(O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Tagetes patula,800963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Tageteae'],['Tagetes'],['Tagetes patula'],4,3,7.373035907745361 2934,5429,283,Fatty acids,Fatty esters,Wax monoesters,0.46825898,ISDB,YSEKNCXYRGKTBJ-UHFFFAOYSA-N,"InChI=1S/C6H10O5/c1-10-5(8)3-4(7)6(9)11-2/h4,7H,3H2,1-2H3",COC(=O)CC(O)C(=O)OC,C6H10O5,,162.05282342,YSEKNCXYRGKTBJ,Fatty acids,Fatty esters,Wax monoesters,Tagetes erecta,717584.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Tageteae'],['Tagetes'],['Tagetes erecta'],4,3,7.373035907745361 2935,5421,916,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.27988416,ISDB,DKVQOAMBVKKPAM-MDZDMXLPSA-N,"InChI=1S/C13H16O/c1-4-13(2,3)10-9-11-5-7-12(14)8-6-11/h4-10,14H,1H2,2-3H3/b10-9+",C=CC(C)(C)/C=C/c1ccc(O)cc1,C13H16O,,188.120115132,DKVQOAMBVKKPAM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cullen corylifolium,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.619536638259888 2936,5421,916,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.27988416,ISDB,DKVQOAMBVKKPAM-MDZDMXLPSA-N,"InChI=1S/C13H16O/c1-4-13(2,3)10-9-11-5-7-12(14)8-6-11/h4-10,14H,1H2,2-3H3/b10-9+",C=CC(C)(C)/C=C/c1ccc(O)cc1,C13H16O,,188.120115132,DKVQOAMBVKKPAM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cullen corylifolia,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.619536638259888 2937,5420,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.0,MS1_match,KQFJWNFKSIQXPX-PYJJOTKASA-N,"InChI=1S/C22H35NO7/c1-4-23-9-19(26)6-5-13(24)21-11-7-10-12(29-2)8-20(27,14(11)15(10)25)22(28,18(21)23)17(30-3)16(19)21/h10-18,24-28H,4-9H2,1-3H3/t10-,11-,12+,13+,14-,15+,16-,17+,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@]2(O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C22H35NO7,pos_2MCH3CNNa,425.24135246,KQFJWNFKSIQXPX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium scabriflorum,6131796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium scabriflorum'],6,0,6.0 2938,5420,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.0,MS1_match,KQFJWNFKSIQXPX-JBVFEIDLSA-N,"InChI=1S/C22H35NO7/c1-4-23-9-19(26)6-5-13(24)21-11-7-10-12(29-2)8-20(27,14(11)15(10)25)22(28,18(21)23)17(30-3)16(19)21/h10-18,24-28H,4-9H2,1-3H3/t10-,11-,12+,13+,14-,15-,16-,17+,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@]2(O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C22H35NO7,pos_2MCH3CNNa,425.24135246,KQFJWNFKSIQXPX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii var. bonvalotii,274603.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bonvalotii'],6,0,6.0 2939,5419,396,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.4881154,ISDB,YUTAFQVKXLDYFG-YTQIUSBHSA-N,"InChI=1S/C16H26O6/c1-9(2)11-5-3-10(4-6-11)8-21-16-15(20)14(19)13(18)12(7-17)22-16/h3,11-20H,1,4-8H2,2H3/t11-,12-,13-,14+,15-,16-/m1/s1",C=C(C)[C@@H]1CC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC1,C16H26O6,,314.17293855199995,YUTAFQVKXLDYFG,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Perilla frutescens,295678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Elsholtzieae'],['Perilla'],['Perilla frutescens'],4,3,7.45246160030365 2940,5416,-1,,,,0.45260668,ISDB,AFXUOKDSKBJSRH-SCSAIBSYSA-N,"InChI=1S/C6H9NO2/c1-3-4(2)9-6(8)5(3)7/h4H,7H2,1-2H3/t4-/m1/s1",CC1=C(N)C(=O)O[C@@H]1C,C6H9NO2,,127.063328528,AFXUOKDSKBJSRH,,,,Quararibea funebris,5762173.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Quararibea'],['Quararibea funebris'],4,0,5.810426712036133 2941,5414,-1,,,,0.0,MS1_match,ZVIQIPQKRVKNLN-GZMMTYOYSA-N,"InChI=1S/C12H16O7/c13-5-8(14)6-19-12(18)11(17)4-7-1-2-9(15)10(16)3-7/h1-3,8,11,13-17H,4-6H2/t8-,11+/m0/s1",O=C(OC[C@@H](O)CO)[C@H](O)Cc1ccc(O)c(O)c1,C12H16O7,pos_2MHCH3CN,272.089602852,ZVIQIPQKRVKNLN,Shikimates and Phenylpropanoids,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 2942,5414,-1,,,,0.0,MS1_match,ZVIQIPQKRVKNLN-GZMMTYOYSA-N,"InChI=1S/C12H16O7/c13-5-8(14)6-19-12(18)11(17)4-7-1-2-9(15)10(16)3-7/h1-3,8,11,13-17H,4-6H2/t8-,11+/m0/s1",O=C(OC[C@@H](O)CO)[C@H](O)Cc1ccc(O)c(O)c1,C12H16O7,pos_2MHCH3CN,272.089602852,ZVIQIPQKRVKNLN,Shikimates and Phenylpropanoids,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 2943,5413,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QQRSPHJOOXUALR-UHFFFAOYSA-N,"InChI=1S/C12H14O4/c1-4-5-8-6-9(13-2)11-12(10(8)14-3)16-7-15-11/h4,6H,1,5,7H2,2-3H3",C=CCc1cc(OC)c2c(c1OC)OCO2,C12H14O4,pos_1_1proton2acetonitrile,222.089208928,QQRSPHJOOXUALR,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 2944,5413,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ATJVZXXHKSYELS-FNORWQNLSA-N,"InChI=1S/C12H14O4/c1-3-16-12(14)7-5-9-4-6-10(13)11(8-9)15-2/h4-8,13H,3H2,1-2H3/b7-5+",CCOC(=O)/C=C/c1ccc(O)c(OC)c1,C12H14O4,pos_1_1proton2acetonitrile,222.089208928,ATJVZXXHKSYELS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Coptis japonica,387829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis japonica'],6,3,7.5 2945,5412,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7189338,ISDB,ORHBXUUXSCNDEV-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H",O=c1ccc2ccc(O)cc2o1,C9H6O3,,162.031694052,ORHBXUUXSCNDEV,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Adonis tianschanica,6130933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis tianschanica'],6,3,10.37573528289795 2946,5412,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7189338,ISDB,ORHBXUUXSCNDEV-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H",O=c1ccc2ccc(O)cc2o1,C9H6O3,,162.031694052,ORHBXUUXSCNDEV,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Adonis mongolica,6130927.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis mongolica'],6,3,10.37573528289795 2947,5409,1351,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.29574555,ISDB,PSQYTAPXSHCGMF-BQYQJAHWSA-N,"InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+",CC(=O)/C=C/C1=C(C)CCCC1(C)C,C13H20O,,192.15141526,PSQYTAPXSHCGMF,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.682982206344604 2948,5408,-1,,,,0.0,MS1_match,YXWUKVNWHJHQJJ-MIWXEKCFSA-N,"InChI=1S/C20H30O12/c1-8-13(23)15(25)17(27)19(30-8)29-7-12-14(24)16(26)18(28)20(32-12)31-11-6-9(4-5-21)2-3-10(11)22/h2-3,6,8,12-28H,4-5,7H2,1H3/t8-,12+,13-,14+,15+,16-,17+,18+,19+,20+/m1/s1",C[C@H]1O[C@H](OC[C@@H]2O[C@H](Oc3cc(CCO)ccc3O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C20H30O12,pos_1_1proton1ammonium,462.1737264,YXWUKVNWHJHQJJ,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],9,0,9.0 2949,5406,283,Fatty acids,Fatty esters,Wax monoesters,0.62640226,ISDB,LDCRTTXIJACKKU-ONEGZZNKSA-N,"InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+",COC(=O)/C=C/C(=O)OC,C6H8O4,,144.042258736,LDCRTTXIJACKKU,Fatty acids,Fatty esters,Wax monoesters,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.005609035491943 2950,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Dracocephalum kotschyi,223863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Dracocephalum'],['Dracocephalum kotschyi'],4,2,7.934038400650024 2951,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Curcuma longa,168258.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Curcuma'],['Curcuma longa'],4,2,7.934038400650024 2952,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Chenopodium ambrosioides,202588.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Atripliceae'],['Chenopodium'],['Chenopodium acuminatum'],4,2,7.934038400650024 2953,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Dysphania ambrosioides,36264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Dysphanieae'],['Dysphania'],['Dysphania ambrosioides'],4,2,7.934038400650024 2954,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Salvia argentea,448585.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia argentea'],4,2,7.934038400650024 2955,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Linum salsoloides,7635380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Linaceae'],['Unknown'],['Linum'],['Linum salsoloides'],4,2,7.934038400650024 2956,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Petroselinum crispum,2485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Petroselinum'],['Petroselinum crispum'],4,2,7.934038400650024 2957,5403,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.7335096,ISDB,XNMPFDIYAMOYRM-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3",C=C(C)C1=CC=C(C)CC1,C10H14,,134.109550448,XNMPFDIYAMOYRM,Terpenoids,Monoterpenoids,,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,2,7.934038400650024 2958,5398,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 2959,5398,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 2960,5397,-1,,,,0.62345636,ISDB,WQGWDDDVZFFDIG-UHFFFAOYSA-N,"InChI=1S/C6H6O3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H",Oc1cccc(O)c1O,C6H6O3,,126.031694052,WQGWDDDVZFFDIG,Shikimates and Phenylpropanoids,,,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,0,8.493825435638428 2961,5397,-1,,,,0.62345636,ISDB,WQGWDDDVZFFDIG-UHFFFAOYSA-N,"InChI=1S/C6H6O3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H",Oc1cccc(O)c1O,C6H6O3,,126.031694052,WQGWDDDVZFFDIG,Shikimates and Phenylpropanoids,,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,8.493825435638428 2962,5396,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.800123,ISDB,TZEMRDVCZWVBHT-UTTQFQDJSA-N,"InChI=1S/C24H24O12/c25-14-5-1-12(9-16(14)27)3-7-19(29)34-11-18-21(31)22(32)23(33)24(35-18)36-20(30)8-4-13-2-6-15(26)17(28)10-13/h1-10,18,21-28,31-33H,11H2/b7-3+,8-4+/t18-,21-,22+,23-,24+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C24H24O12,,504.126776208,TZEMRDVCZWVBHT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Coussarea hydrangeifolia,283716.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coussareeae'],['Coussarea'],['Coussarea hydrangeifolia'],4,3,8.700491905212402 2963,5396,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.800123,ISDB,TZEMRDVCZWVBHT-UTTQFQDJSA-N,"InChI=1S/C24H24O12/c25-14-5-1-12(9-16(14)27)3-7-19(29)34-11-18-21(31)22(32)23(33)24(35-18)36-20(30)8-4-13-2-6-15(26)17(28)10-13/h1-10,18,21-28,31-33H,11H2/b7-3+,8-4+/t18-,21-,22+,23-,24+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C24H24O12,,504.126776208,TZEMRDVCZWVBHT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Prunus buergeriana,528520.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus buergeriana'],4,3,8.700491905212402 2964,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,3,7.5 2965,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,3,7.5 2966,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum altaicum,6131341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum altaicum'],6,3,7.5 2967,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 2968,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum turczaninowii,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 2969,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium sclerocladum,784176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella scleroclada'],6,3,7.5 2970,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-AYUVKHDASA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20?,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32+,33+,34-/m1/s1",CCN1C[C@]2(COC)C(O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum liangshanicum,111880.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum liangshanicum'],6,3,7.5 2971,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,3,7.5 2972,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,3,7.5 2973,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 2974,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 2975,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum henryi,5511349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum henryi'],6,3,7.5 2976,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sungpanense,1042521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sungpanense'],6,3,7.5 2977,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum confertiflorum,3944951.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum confertiflorum'],6,3,7.5 2978,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 2979,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,3,7.5 2980,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-DTIGCWNHSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21-,22-,23+,24+,25-,26-,27-,28+,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum chasmanthum,5737840.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chasmanthum'],6,3,7.5 2981,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-UVNSTBNHSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24-,25-,26-,27+,28-,29+,31+,32-,33+,34+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@](OC(C)=O)([C@@H]([C@@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongoricum,6131511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongoricum'],6,3,7.5 2982,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum brunneum,413968.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum brunneum'],6,3,7.5 2983,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 2984,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum firmum,5737794.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum firmum'],6,3,7.5 2985,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum zigzag,5737818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum zigzag'],6,3,7.5 2986,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum grossedentatum,5922991.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum grossedentatum'],6,3,7.5 2987,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum polyschistum,6131475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum polyschistum'],6,3,7.5 2988,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum brachypodum,50012.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum brachypodum'],6,3,7.5 2989,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ferox,1014250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ferox'],6,3,7.5 2990,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-UHFFFAOYSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3",CCN1CC2(COC)C(O)CC(OC)C34C5CC6(O)C(OC)C(O)C(OC(C)=O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 2991,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-QGLVITRHSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20+,21-,22+,23-,24+,25+,26+,27+,28-,29-,31-,32+,33-,34+/m0/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@H]([C@@H]13)[C@]1(OC(C)=O)[C@H]2[C@H](OC(=O)c3ccccc3)[C@](O)(C[C@@H]24)[C@@H](OC)[C@H]1O,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 2992,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HZQIKAUHRQRVMI-CGMWZCGWSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)14-20(37)27(43-5)33-19-13-32(40)28(45-30(39)18-11-9-8-10-12-18)21(19)34(46-17(2)36,26(38)29(32)44-6)22(25(33)35)23(42-4)24(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20+,21-,22+,23-,24-,25-,26+,27+,28-,29+,31+,32-,33+,34+/m1/s1",CCN1C[C@]2(COC)C[C@H](O)[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@](OC(C)=O)([C@@H]([C@@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.314911324,HZQIKAUHRQRVMI,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,3,7.5 2993,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum flavum,44348.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum flavum'],6,3,7.5 2994,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,FIAJCJWCEPHUJF-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(45-17(2)36)13-21(42-4)33-19-14-32(39)28(46-30(38)18-11-9-8-10-12-18)22(19)34(40,27(37)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37,39-40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@@]2(COC)[C@H]3[C@@H](OC)[C@H]4[C@@H]1[C@]3([C@@H](OC)C[C@H]2OC(C)=O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)c3ccccc3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC,C34H47NO11,pos_1_1proton1methanol,645.314911324,FIAJCJWCEPHUJF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum polyschistum,6131475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum polyschistum'],6,3,7.5 2995,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum volubile,549540.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum volubile'],6,3,7.5 2996,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-QGLVITRHSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20+,21-,22+,23-,24+,25+,26+,27+,28-,29-,31-,32+,33-,34+/m0/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@H]([C@@H]13)[C@]1(OC(C)=O)[C@H]2[C@H](OC(=O)c3ccccc3)[C@](O)(C[C@@H]24)[C@@H](OC)[C@H]1O,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 2997,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum volubile,549540.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum volubile'],6,3,7.5 2998,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 2999,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,3,7.5 3000,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum altaicum,6131341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum altaicum'],6,3,7.5 3001,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 3002,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum turczaninowii,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 3003,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium sclerocladum,784176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella scleroclada'],6,3,7.5 3004,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-AYUVKHDASA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20?,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32+,33+,34-/m1/s1",CCN1C[C@]2(COC)C(O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum liangshanicum,111880.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum liangshanicum'],6,3,7.5 3005,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,3,7.5 3006,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,3,7.5 3007,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 3008,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 3009,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum henryi,5511349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum henryi'],6,3,7.5 3010,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,3,7.5 3011,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sungpanense,1042521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sungpanense'],6,3,7.5 3012,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,3,7.5 3013,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum flavum,44348.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum flavum'],6,3,7.5 3014,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-DTIGCWNHSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21-,22-,23+,24+,25-,26-,27-,28+,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum chasmanthum,5737840.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum chasmanthum'],6,3,7.5 3015,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-UVNSTBNHSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24-,25-,26-,27+,28-,29+,31+,32-,33+,34+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@](OC(C)=O)([C@@H]([C@@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.314911324,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongoricum,6131511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongoricum'],6,3,7.5 3016,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum brunneum,413968.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum brunneum'],6,3,7.5 3017,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 3018,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum firmum,5737794.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum firmum'],6,3,7.5 3019,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum zigzag,5737818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum zigzag'],6,3,7.5 3020,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum grossedentatum,5922991.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum grossedentatum'],6,3,7.5 3021,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum polyschistum,6131475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum polyschistum'],6,3,7.5 3022,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-NPVHKAFCSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum brachypodum,50012.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum brachypodum'],6,3,7.5 3023,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ferox,1014250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ferox'],6,3,7.5 3024,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-UHFFFAOYSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3",CCN1CC2(COC)C(O)CC(OC)C34C5CC6(O)C(OC)C(O)C(OC(C)=O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 3025,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XFSBVAOIAHNAPC-XTHSEXKGSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@H]24)[C@@H](OC)[C@@H]1O,C34H47NO11,pos_1_1proton1methanol,645.3149113239998,XFSBVAOIAHNAPC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum confertiflorum,3944951.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum confertiflorum'],6,3,7.5 3026,5394,463,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,GGHMHFVQNSKFFD-NWVDYVGVSA-N,"InChI=1S/C34H47NO11/c1-7-35-15-30(16-42-3)19(46-17(2)36)13-20(43-4)33-26(30)24(44-5)22(27(33)35)34(41)25-21(23(37)18-11-9-8-10-12-18)31(39,14-32(25,33)40)29(45-6)28(34)38/h8-12,19-22,24-29,38-41H,7,13-16H2,1-6H3/t19-,20-,21+,22+,24+,25+,26-,27-,28+,29+,30+,31-,32+,33-,34+/m1/s1",CCN1C[C@@]2(COC)[C@H]3[C@@H](OC)[C@H]4[C@@H]1[C@]3([C@H](OC)C[C@H]2OC(C)=O)[C@]1(O)C[C@]2(O)[C@@H](OC)[C@H](O)[C@@]4(O)[C@H]1[C@@H]2C(=O)c1ccccc1,C34H47NO11,pos_1_1proton1methanol,645.314911324,GGHMHFVQNSKFFD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum polyschistum,6131475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum polyschistum'],6,3,7.5 3027,5383,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.78733665,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya paniculata,81668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya paniculata'],4,3,8.649346590042114 3028,5383,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.78733665,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya exotica,755734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya exotica'],4,3,8.649346590042114 3029,5381,-1,,,,0.0,MS1_match,QRQAYVQOURYHFI-XHRCHVEDSA-N,"InChI=1S/C37H48N2O12/c1-7-38-17-33(51-31(43)20-10-8-9-11-22(20)39-25(41)14-18(2)30(39)42)13-12-24(48-5)36-28(33)29(49-6)37(46,32(36)38)35(45)16-23(47-4)21-15-34(36,44)27(35)26(21)50-19(3)40/h8-11,18,21,23-24,26-29,32,44-46H,7,12-17H2,1-6H3/t18-,21+,23-,24-,26-,27-,28+,29-,32-,33+,34-,35+,36+,37+/m0/s1",CCN1C[C@]2(OC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC(C)=O,C37H48N2O12,pos_2_2proton,712.320724976,QRQAYVQOURYHFI,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 3030,5381,-1,,,,0.0,MS1_match,YNVHPKZOSKERBV-JEXDJHFJSA-N,"InChI=1S/C37H48N2O12/c1-18-13-24(41)39(31(18)43)22-10-8-7-9-19(22)32(44)51-16-34-12-11-23(46-2)35-21-14-20-26(47-3)25(21)37(50-6,29(42)27(20)48-4)36(45,30(49-5)28(34)35)33(35)38(15-34)17-40/h7-10,17-18,20-21,23,25-30,33,42,45H,11-16H2,1-6H3/t18?,20-,21+,23-,25+,26-,27+,28+,29+,30-,33-,34-,35-,36+,37-/m0/s1",CO[C@@H]1[C@H]2C[C@@H]3[C@H]([C@H]2OC)[C@](OC)([C@@H]1O)[C@@]1(O)[C@@H](OC)[C@@H]2[C@@]4(COC(=O)c5ccccc5N5C(=O)CC(C)C5=O)CC[C@H](OC)[C@@]32[C@@H]1N(C=O)C4,C37H48N2O12,pos_2_2proton,712.320724976,YNVHPKZOSKERBV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii,699542.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium potaninii'],6,0,6.0 3031,5375,857,Amino acids and Peptides,Small peptides,Aminoacids,0.76088923,ISDB,SRXKAYJJGAAOBP-LURJTMIESA-N,"InChI=1S/C7H14N2O3/c1-5(10)9-4-2-3-6(8)7(11)12/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1",CC(=O)NCCC[C@H](N)C(=O)O,C7H14N2O3,,174.100442308,SRXKAYJJGAAOBP,Amino acids and Peptides,Small peptides,Aminoacids,Corydalis ochotensis,818452.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis ochotensis'],5,3,9.543556928634644 3032,5375,857,Amino acids and Peptides,Small peptides,Aminoacids,0.76088923,ISDB,SRXKAYJJGAAOBP-LURJTMIESA-N,"InChI=1S/C7H14N2O3/c1-5(10)9-4-2-3-6(8)7(11)12/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1",CC(=O)NCCC[C@H](N)C(=O)O,C7H14N2O3,,174.100442308,SRXKAYJJGAAOBP,Amino acids and Peptides,Small peptides,Aminoacids,Corydalis sibirica,5727947.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis sibirica'],5,3,9.543556928634644 3033,5375,857,Amino acids and Peptides,Small peptides,Aminoacids,0.76088923,ISDB,SRXKAYJJGAAOBP-LURJTMIESA-N,"InChI=1S/C7H14N2O3/c1-5(10)9-4-2-3-6(8)7(11)12/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1",CC(=O)NCCC[C@H](N)C(=O)O,C7H14N2O3,,174.100442308,SRXKAYJJGAAOBP,Amino acids and Peptides,Small peptides,Aminoacids,Corydalis cornuta,6130333.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis cornuta'],5,3,9.543556928634644 3034,5373,-1,,,,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_2_2proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3035,5373,-1,,,,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_2_2proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,0,8.0 3036,5373,-1,,,,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_2_2proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],8,0,8.0 3037,5372,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BOPNBEMHPYANDR-QSHXVNPLSA-N,"InChI=1S/C17H22O11/c1-5(20)10-6(21)2-7(22)11(13(10)24)15-9(4-19)26-16-14(25)12(23)8(3-18)27-17(16)28-15/h2,8-9,12,14-19,21-25H,3-4H2,1H3/t8-,9+,12-,14+,15-,16-,17+/m1/s1",CC(=O)c1c(O)cc(O)c([C@@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@H]2CO)c1O,C17H22O11,pos_1_1proton1methanol,402.116211524,BOPNBEMHPYANDR,Polyketides,Phloroglucinols,Acyl phloroglucinols,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,0,7.0 3038,5371,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3039,5371,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3040,5371,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3041,5371,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1ammonium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3042,5371,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1ammonium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3043,5371,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1ammonium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3044,5371,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3045,5371,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1ammonium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3046,5368,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,IPRPPFIAVHPVJH-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2",O=CCc1ccc(O)cc1,C8H8O2,pos_1_1proton1ammonium,136.052429496,IPRPPFIAVHPVJH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,3,9.5 3047,5367,801,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.43276605,ISDB,IPRPPFIAVHPVJH-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2",O=CCc1ccc(O)cc1,C8H8O2,,136.052429496,IPRPPFIAVHPVJH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,1,10.231064200401306 3048,5365,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.529777,ISDB,CMXCLTFHXRTSPB-WIXFNSMHSA-N,"InChI=1S/C30H44O2/c1-18(2)9-7-10-19(3)23-14-22-16-30(25(23)13-21(22)5)26-15-24-20(4)11-8-12-29(24,6)17-27(26)32-28(30)31/h9,13,15,19-20,22-23,25-27H,7-8,10-12,14,16-17H2,1-6H3/t19-,20-,22+,23-,25-,26-,27+,29+,30-/m0/s1",CC(C)=CCC[C@H](C)[C@@H]1C[C@@H]2C[C@]3(C(=O)O[C@@H]4C[C@@]5(C)CCC[C@H](C)C5=C[C@@H]43)[C@H]1C=C2C,C30H44O2,,436.334130648,CMXCLTFHXRTSPB,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Helenium autumnale,483908.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Helenium'],['Helenium autumnale'],4,2,7.119107961654663 3049,5364,-1,,,,0.39614668,ISDB,HBRFKORKLCCQOQ-IDOKYYSUSA-N,"InChI=1S/C18H28O3/c1-11-15(20)13(19)9-14-17(11,3)6-5-12-10-16(2,21)7-8-18(12,14)4/h12,14,20-21H,5-10H2,1-4H3/t12-,14-,16-,17+,18-/m0/s1",CC1=C(O)C(=O)C[C@@H]2[C@@]3(C)CC[C@](C)(O)C[C@@H]3CC[C@]12C,C18H28O3,,292.203844756,HBRFKORKLCCQOQ,Terpenoids,Diterpenoids,Erythroxylane diterpenoids,Ceriops tagal,163833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Rhizophoraceae'],['Unknown'],['Ceriops'],['Ceriops tagal'],4,0,5.5845867395401 3050,5361,-1,,,,0.0,MS1_match,BRPXPVJDVKIHQK-UHFFFAOYSA-N,"InChI=1S/C39H42N2O7/c1-25(2)30-16-17-39(24-45-35(42)27-10-6-5-7-11-27)33(47-37(44)29-13-9-19-41-23-29)20-26(3)14-15-32-38(4,48-32)21-31(34(30)39)46-36(43)28-12-8-18-40-22-28/h5-13,18-20,22-23,31-34H,14-17,21,24H2,1-4H3",CC1=CC(OC(=O)c2cccnc2)C2(COC(=O)c3ccccc3)CCC(=C(C)C)C2C(OC(=O)c2cccnc2)CC2(C)OC2CC1,C39H42N2O7,pos_1_1proton2acetonitrile,650.299201684,BRPXPVJDVKIHQK,Terpenoids,Diterpenoids,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 3051,5361,-1,,,,0.0,MS1_match,LRVALJHYZOUSDW-KYJUHHDHSA-N,"InChI=1S/C39H42N2O7/c1-40-13-11-23-17-31(42-2)34-20-28(23)29(40)15-22-7-9-26(10-8-22)47-33-18-24-16-30-35-27(12-14-41(30)21-25(24)19-32(33)43-3)36(44-4)38(45-5)39(46-6)37(35)48-34/h7-10,17-20,29-30H,11-16,21H2,1-6H3/t29-,30-/m0/s1",COc1cc2c3cc1Oc1ccc(cc1)C[C@H]1c4cc(c(OC)cc4CCN1C)Oc1c(OC)c(OC)c(OC)c4c1[C@H](C3)N(CC4)C2,C39H42N2O7,pos_1_1proton2acetonitrile,650.299201684,LRVALJHYZOUSDW,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum longistylum,6133329.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum longistylum'],6,0,6.0 3052,5359,647,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,0.3405713,ISDB,GGVTWFRUJRJVGT-GMVOTWDCSA-N,"InChI=1S/C20H23NO5/c1-23-13-6-5-12-7-19(22)21-11-18(26-4)14-8-16(24-2)17(25-3)9-15(14)20(12,21)10-13/h5-9,13,18H,10-11H2,1-4H3/t13-,18-,20-/m0/s1",COc1cc2c(cc1OC)[C@]13C[C@@H](OC)C=CC1=CC(=O)N3C[C@@H]2OC,C20H23NO5,,357.157622836,GGVTWFRUJRJVGT,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Erythrina lysistemon,284184.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Erythrina'],['Erythrina lysistemon'],4,3,6.862285256385803 3053,5358,152,Fatty acids,Fatty Acids and Conjugates,Eremophilane sesquiterpenoids,0.7384343,ISDB,RVEKLXYYCHAMDF-AOSYACOCSA-N,"InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h4-5,7-8H,2-3,6,9-15H2,1H3,(H,17,18)/b5-4+,8-7+",CCC/C=C/C/C=C/CCCCCCCC(=O)O,C16H28O2,,252.208930136,RVEKLXYYCHAMDF,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Asclepias syriaca,148395.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Asclepias'],['Asclepias syriaca'],4,2,7.953737258911133 3054,5354,-1,,,,0.0,MS1_match,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,pos_1_1proton1methanol,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3055,5354,-1,,,,0.0,MS1_match,UTNQUNGFEKWBQT-HHHGZCDHSA-N,"InChI=1S/C15H26O2/c1-10(2)11-8-14(4)13(3)6-5-7-15(14,16)17-12(11)9-13/h10-12,16H,5-9H2,1-4H3/t11-,12-,13+,14-,15?/m1/s1",CC(C)[C@H]1C[C@@]2(C)C3(O)CCC[C@@]2(C)C[C@H]1O3,C15H26O2,pos_1_1proton1methanol,238.193280072,UTNQUNGFEKWBQT,Terpenoids,Sesquiterpenoids,Valerane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3056,5354,-1,,,,0.0,MS1_match,XSCKUUHHFRRUMW-RBSFLKMASA-N,"InChI=1S/C15H26O2/c1-11(2)6-5-7-13(4)15(17)9-8-12(3)10-14(15)16/h6,10,13-14,16-17H,5,7-9H2,1-4H3/t13-,14-,15-/m1/s1",CC(C)=CCC[C@@H](C)[C@]1(O)CCC(C)=C[C@H]1O,C15H26O2,pos_1_1proton1methanol,238.193280072,XSCKUUHHFRRUMW,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3057,5354,-1,,,,0.0,MS1_match,XSCKUUHHFRRUMW-RBSFLKMASA-N,"InChI=1S/C15H26O2/c1-11(2)6-5-7-13(4)15(17)9-8-12(3)10-14(15)16/h6,10,13-14,16-17H,5,7-9H2,1-4H3/t13-,14-,15-/m1/s1",CC(C)=CCC[C@@H](C)[C@]1(O)CCC(C)=C[C@H]1O,C15H26O2,pos_1_1proton1methanol,238.193280072,XSCKUUHHFRRUMW,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3058,5354,-1,,,,0.0,MS1_match,SJKFIHGLULSUCA-SNPRPXQTSA-N,"InChI=1S/C15H26O2/c1-11(2)12-6-8-15(10-16)7-4-5-13(17)14(15,3)9-12/h11-12,16H,4-10H2,1-3H3/t12-,14+,15+/m1/s1",CC(C)[C@@H]1CC[C@]2(CO)CCCC(=O)[C@]2(C)C1,C15H26O2,pos_1_1proton1methanol,238.193280072,SJKFIHGLULSUCA,Terpenoids,Sesquiterpenoids,Valerane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3059,5354,-1,,,,0.0,MS1_match,SJKFIHGLULSUCA-SNPRPXQTSA-N,"InChI=1S/C15H26O2/c1-11(2)12-6-8-15(10-16)7-4-5-13(17)14(15,3)9-12/h11-12,16H,4-10H2,1-3H3/t12-,14+,15+/m1/s1",CC(C)[C@@H]1CC[C@]2(CO)CCCC(=O)[C@]2(C)C1,C15H26O2,pos_1_1proton1methanol,238.193280072,SJKFIHGLULSUCA,Terpenoids,Sesquiterpenoids,Valerane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3060,5354,-1,,,,0.0,MS1_match,WKGPQOAMUAIBRO-FCNPYSRZSA-N,"InChI=1S/C15H26O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10-,11-,12+,14-,15+/m0/s1",C[C@H]1CC[C@@]2(O)C(C)(C)[C@H]3C[C@@H]1[C@]2(C)C[C@H]3O,C15H26O2,pos_1_1proton1methanol,238.193280072,WKGPQOAMUAIBRO,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3061,5354,-1,,,,0.0,MS1_match,SCYYILSHQOYTTA-CGNPOWQISA-N,"InChI=1S/C15H26O2/c1-9-5-6-11-10(9)7-12-13(16)8-15(11,4)17-14(12,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10-,11-,12+,13+,15+/m1/s1",C[C@@H]1CC[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,SCYYILSHQOYTTA,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3062,5354,-1,,,,0.0,MS1_match,WKGPQOAMUAIBRO-FCNPYSRZSA-N,"InChI=1S/C15H26O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10-,11-,12+,14-,15+/m0/s1",C[C@H]1CC[C@@]2(O)C(C)(C)[C@H]3C[C@@H]1[C@]2(C)C[C@H]3O,C15H26O2,pos_1_1proton1methanol,238.193280072,WKGPQOAMUAIBRO,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3063,5354,-1,,,,0.0,MS1_match,ZADVMZUKWWMSLQ-PVZBEVCSSA-N,"InChI=1S/C15H26O2/c1-9-7-12(16)13-11(9)8-10-5-6-15(13,4)17-14(10,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10+,11-,12-,13+,15-/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@@H]1CC[C@@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,ZADVMZUKWWMSLQ,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3064,5354,-1,,,,0.0,MS1_match,ZADVMZUKWWMSLQ-PVZBEVCSSA-N,"InChI=1S/C15H26O2/c1-9-7-12(16)13-11(9)8-10-5-6-15(13,4)17-14(10,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10+,11-,12-,13+,15-/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@@H]1CC[C@@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,ZADVMZUKWWMSLQ,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3065,5354,-1,,,,0.0,MS1_match,ZGRPWWDOSQIIIF-UHFFFAOYSA-N,"InChI=1S/C15H26O2/c1-10-5-8-13(16)12-7-6-11(14(2,3)17)9-15(10,12)4/h10-12,17H,5-9H2,1-4H3",CC1CCC(=O)C2CCC(C(C)(C)O)CC12C,C15H26O2,pos_1_1proton1methanol,238.193280072,ZGRPWWDOSQIIIF,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3066,5354,-1,,,,0.0,MS1_match,MPYYVGIJHREDBO-SLEUVZQESA-N,"InChI=1S/C15H26O2/c1-10(2)8-13(16)17-12-9-11-6-7-15(12,5)14(11,3)4/h10-12H,6-9H2,1-5H3/t11-,12-,15+/m0/s1",CC(C)CC(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,MPYYVGIJHREDBO,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3067,5354,-1,,,,0.0,MS1_match,FXNFQZVVVKRJEG-IWTMDLJTSA-N,"InChI=1S/C15H26O2/c1-10-4-5-13-12(10)8-11-6-7-14(13,2)17-15(11,3)9-16/h10-13,16H,4-9H2,1-3H3/t10-,11+,12-,13-,14-,15-/m0/s1",C[C@H]1CC[C@H]2[C@H]1C[C@H]1CC[C@]2(C)O[C@@]1(C)CO,C15H26O2,pos_1_1proton1methanol,238.193280072,FXNFQZVVVKRJEG,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3068,5354,-1,,,,0.0,MS1_match,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,pos_1_1proton1methanol,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3069,5354,-1,,,,0.0,MS1_match,WKGPQOAMUAIBRO-KPRRGPHJSA-N,"InChI=1S/C15H26O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10-,11-,12-,14-,15+/m0/s1",C[C@H]1CC[C@@]2(O)C(C)(C)[C@H]3C[C@@H]1[C@]2(C)C[C@@H]3O,C15H26O2,pos_1_1proton1methanol,238.193280072,WKGPQOAMUAIBRO,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3070,5354,-1,,,,0.0,MS1_match,SCYYILSHQOYTTA-CGNPOWQISA-N,"InChI=1S/C15H26O2/c1-9-5-6-11-10(9)7-12-13(16)8-15(11,4)17-14(12,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10-,11-,12+,13+,15+/m1/s1",C[C@@H]1CC[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,SCYYILSHQOYTTA,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3071,5353,176,Terpenoids,Steroids,Furostane steroids,0.0,MS1_match,UULJFDBVPOLIGQ-XCTMGHGWSA-N,"InChI=1S/C33H52O10/c1-16-24-22(12-20-19-6-5-17-11-18(35)7-8-31(17,3)25(19)21(36)13-32(20,24)4)42-33(16)10-9-30(2,43-33)15-40-29-28(39)27(38)26(37)23(14-34)41-29/h5,16,18-29,34-39H,6-15H2,1-4H3/t16-,18-,19-,20-,21+,22-,23+,24-,25+,26+,27-,28+,29+,30-,31-,32-,33-/m0/s1",C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4[C@H](O)C[C@]23C)O[C@]12CC[C@@](C)(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O2,C33H52O10,pos_1_1proton1ethylamine,608.356047864,UULJFDBVPOLIGQ,Terpenoids,Steroids,Furostane steroids,Helleborus orientalis,648046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus orientalis'],6,3,7.5 3072,5351,-1,,,,0.7903506,ISDB,XICKQNFAJAXFNI-UHFFFAOYSA-N,"InChI=1S/C19H18O7/c1-8-14(22)13-15(23)19(25-4)18(10-5-6-11(20)12(21)7-10)26-17(13)9(2)16(8)24-3/h5-7,20-22H,1-4H3",COc1c(C)c(O)c2c(=O)c(OC)c(-c3ccc(O)c(O)c3)oc2c1C,C19H18O7,,358.105252916,XICKQNFAJAXFNI,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Piliostigma thonningii,276253.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Piliostigma'],['Piliostigma thonningii'],4,0,7.161402463912964 3073,5350,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 3074,5350,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,2,7.0 3075,5350,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 3076,5350,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,2,7.0 3077,5350,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 3078,5350,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,2,7.0 3079,5341,332,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HILVYHXTZGYQOP-UHFFFAOYSA-N,"InChI=1S/C34H42O15/c1-16-25(43-18(3)36)27(44-19(4)37)30(47-22(7)40)33(15-42-17(2)35)29(46-21(6)39)26(48-31(41)23-13-11-10-12-14-23)24-28(45-20(5)38)34(16,33)49-32(24,8)9/h10-14,16,24-30H,15H2,1-9H3",CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(C)C13OC(C)(C)C(C(OC(=O)c1ccccc1)C2OC(C)=O)C3OC(C)=O,C34H42O15,pos_2_2proton2acetonitrile,690.252370644,HILVYHXTZGYQOP,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,3,8.5 3080,5340,507,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-PXKJKYEHSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22+,23-,25-,26-,27+/m0/s1",CC(=O)OC[C@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_1_sodium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 3081,5340,507,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-UHFFFAOYSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3",CC(=O)OCC1(O)C(O)CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C21,C27H42O12,pos_1_sodium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 3082,5340,507,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-HXTWUXIJSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22-,23-,25-,26-,27-/m0/s1",CC(=O)OC[C@@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_1_sodium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3083,5331,1188,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,RPUCXGXPWYXBOD-UHFFFAOYSA-N,"InChI=1S/C29H37NO12/c1-15(31)37-14-28-22(41-25(35)19-9-8-10-30-13-19)11-20-23(39-17(3)33)29(28,42-26(20,5)6)27(7,36)12-21(38-16(2)32)24(28)40-18(4)34/h8-10,13,20-24,36H,11-12,14H2,1-7H3",CC(=O)OCC12C(OC(=O)c3cccnc3)CC3C(OC(C)=O)C1(OC3(C)C)C(C)(O)CC(OC(C)=O)C2OC(C)=O,C29H37NO12,pos_1_1proton,591.231575624,RPUCXGXPWYXBOD,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Gymnosporia ovata,6092769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia ovata'],6,3,7.5 3084,5331,1188,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,ZIJTXZAMPUCYSG-HFOQERPQSA-N,"InChI=1S/C29H34O12/c1-15(30)37-20-14-27(5,34)29-22(40-25(33)19-10-8-12-36-19)17(26(3,4)41-29)13-21(28(29,6)23(20)38-16(2)31)39-24(32)18-9-7-11-35-18/h7-12,17,20-23,34H,13-14H2,1-6H3/t17-,20+,21+,22-,23+,27+,28-,29+/m1/s1",CC(=O)O[C@H]1C[C@](C)(O)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccco4)[C@]2(C)[C@H]1OC(C)=O)[C@H]3OC(=O)c1ccco1,C29H34O12,pos_1_1proton1ammonium,574.205026528,ZIJTXZAMPUCYSG,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia cuzcoina,6092941.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia cuzcoina'],6,3,7.5 3085,5331,1188,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,DYAWIECXRLDDTM-ALCSWTQMSA-N,"InChI=1S/C29H34O12/c1-15(30)37-19-7-10-27(5,34)29-22(39-24(32)17-8-11-35-13-17)20(26(3,4)41-29)21(38-16(2)31)23(28(19,29)6)40-25(33)18-9-12-36-14-18/h8-9,11-14,19-23,34H,7,10H2,1-6H3/t19-,20+,21-,22-,23+,27+,28-,29-/m0/s1",CC(=O)O[C@H]1[C@@H]2[C@H](OC(=O)c3ccoc3)[C@@]3(OC2(C)C)[C@@](C)([C@@H](OC(C)=O)CC[C@@]3(C)O)[C@@H]1OC(=O)c1ccoc1,C29H34O12,pos_1_1proton1ammonium,574.205026528,DYAWIECXRLDDTM,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus boaria,418513.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus boaria'],6,3,7.5 3086,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Aristolochia mollissima,656355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia mollissima'],4,1,5.44458270072937 3087,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,1,5.44458270072937 3088,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Platostoma palustre,285422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Platostoma'],['Platostoma chinense'],4,1,5.44458270072937 3089,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Spinacia oleracea,317784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Anserineae'],['Spinacia'],['Spinacia oleracea'],4,1,5.44458270072937 3090,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Olea europaea,23729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Oleeae'],['Olea'],['Olea europaea'],4,1,5.44458270072937 3091,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,1,5.44458270072937 3092,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Euchresta formosana,280933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Euchresta'],['Euchresta formosana'],4,1,5.44458270072937 3093,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Tapura fischeri,204812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Dichapetalaceae'],['Unknown'],['Tapura'],['Tapura fischeri'],4,1,5.44458270072937 3094,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Saussurea medusa,474462.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea medusa'],4,1,5.44458270072937 3095,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Alloberberis fremontii,725518.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fremontii'],4,1,5.44458270072937 3096,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ophiorrhiza pumila,608350.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Ophiorrhizeae'],['Ophiorrhiza'],['Ophiorrhiza pumila'],4,1,5.44458270072937 3097,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliata,5503578.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifolia'],4,1,5.44458270072937 3098,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliolata,840498.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifoliolata'],4,1,5.44458270072937 3099,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Phellodendron chinense,710068.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Phellodendron'],['Phellodendron chinense'],4,1,5.44458270072937 3100,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ajuga taiwanensis,367347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Ajuga'],['Ajuga taiwanensis'],4,1,5.44458270072937 3101,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Isotrema kaempferi,656366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia kaempferi'],4,1,5.44458270072937 3102,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Aristolochia kaempferi,656366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia kaempferi'],4,1,5.44458270072937 3103,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Centaurea malacitana,7613211.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Centaurea'],['Centaurea malacitana'],4,1,5.44458270072937 3104,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Richardia grandiflora,3872538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Richardia'],['Richardia grandiflora'],4,1,5.44458270072937 3105,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis fendleri,854435.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fendleri'],4,1,5.44458270072937 3106,5330,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23614568,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ocimum labiatum,588789.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Ocimum'],['Ocimum labiatum'],4,1,5.44458270072937 3107,5329,625,Terpenoids,Diterpenoids,Pregnane steroids,0.48837522,ISDB,PQNOCJMPOHKMIT-HMCHPOHQSA-N,"InChI=1S/C22H36O4/c1-5-12-16(23)11-22(4)14-6-7-15-18(25)19(26)17(24)10-20(15,2)13(14)8-9-21(12,22)3/h12-15,17-19,24-26H,5-11H2,1-4H3/t12-,13-,14+,15+,17-,18+,19-,20+,21+,22-/m0/s1",CC[C@H]1C(=O)C[C@@]2(C)[C@@H]3CC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C22H36O4,,364.261359632,PQNOCJMPOHKMIT,Terpenoids,Steroids,Pregnane steroids,Dysoxylum densiflorum,5747793.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Dysoxylum'],['Dysoxylum densiflorum'],4,3,7.453500866889954 3108,5329,625,Terpenoids,Diterpenoids,Pregnane steroids,0.48837522,ISDB,PQNOCJMPOHKMIT-HMCHPOHQSA-N,"InChI=1S/C22H36O4/c1-5-12-16(23)11-22(4)14-6-7-15-18(25)19(26)17(24)10-20(15,2)13(14)8-9-21(12,22)3/h12-15,17-19,24-26H,5-11H2,1-4H3/t12-,13-,14+,15+,17-,18+,19-,20+,21+,22-/m0/s1",CC[C@H]1C(=O)C[C@@]2(C)[C@@H]3CC[C@@H]4[C@@H](O)[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C22H36O4,,364.261359632,PQNOCJMPOHKMIT,Terpenoids,Steroids,Pregnane steroids,Epicharis densiflora,5747793.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Dysoxylum'],['Dysoxylum densiflorum'],4,3,7.453500866889954 3109,5328,578,Fatty acids,Monoterpenoids,Menthane monoterpenoids,0.0,MS1_match,HFPZCAJZSCWRBC-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3",Cc1ccc(C(C)C)cc1,C10H14,pos_1_1proton1methanol,134.109550448,HFPZCAJZSCWRBC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3110,5326,563,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,JUJTUEBXXGRSJB-MTAKFWDWSA-N,"InChI=1S/C17H26O9/c1-3-9-10-4-12(22-2)23-6-8(10)7-24-16(9)26-17-15(21)14(20)13(19)11(5-18)25-17/h3,7,9-21H,1,4-6H2,2H3/t9-,10-,11-,12-,13-,14+,15-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2CO[C@@H](OC)C[C@H]21,C17H26O9,pos_2MHCH3CN,374.1576824119999,JUJTUEBXXGRSJB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 3111,5325,214,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HRGUSFBJBOKSML-UHFFFAOYSA-N,"InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)17(14)21)12-7-11(20)16-10(19)5-9(18)6-13(16)24-12/h3-7,18-19,21H,1-2H3",COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc(OC)c1O,C17H14O7,pos_1_1proton,330.073952788,HRGUSFBJBOKSML,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,2,7.0 3112,5324,-1,,,,0.608188,ISDB,SDJMNNDDHQWWJH-UXCAXZQLSA-N,"InChI=1S/C18H26O3/c1-16-6-5-14(20)8-12(16)4-7-17-9-13(2-3-15(16)17)18(21,10-17)11-19/h5-6,12-13,15,19,21H,2-4,7-11H2,1H3/t12-,13-,15+,16-,17+,18+/m1/s1",C[C@@]12C=CC(=O)C[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(CO)C3,C18H26O3,,290.188194692,SDJMNNDDHQWWJH,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Diplospora dubia,729058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora dubia'],4,0,6.432751893997192 3113,5320,-1,,,,0.33725712,ISDB,SXCVPGXYCJAUPB-YLAKUSLOSA-N,"InChI=1S/C20H32O3/c1-13(2)15-7-8-20(6)11-16(9-14(3)17(20)10-15)23-18(21)12-19(4,5)22/h15-17,22H,1,3,7-12H2,2,4-6H3/t15-,16+,17+,20+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](OC(=O)CC(C)(C)O)CC(=C)[C@@H]2C1,C20H32O3,,320.235144884,SXCVPGXYCJAUPB,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,7.349028468132019 3114,5316,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,XXZPXRQPWFAXCK-WQFMGJDKSA-N,"InChI=1S/C17H26O5/c1-10(2)7-15(19)22-17-16-11(3)5-6-14(16)13(9-21-17)8-20-12(4)18/h9-11,14,16-17H,5-8H2,1-4H3/t11-,14+,16+,17-/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1CC[C@@H]2C,C17H26O5,pos_1_1proton2acetonitrile,310.178023932,XXZPXRQPWFAXCK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 3115,5312,701,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,LTRLDPJSMLPKMF-YKXWAFRCSA-N,"InChI=1S/C25H40O10/c1-12-9-14(26)10-25(3,4)15(12)6-5-13(2)34-24-23(32)22(31)21(30)18(35-24)11-33-17-8-7-16(27)19(28)20(17)29/h5-6,9,13,15-24,27-32H,7-8,10-11H2,1-4H3/b6-5+/t13-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2CC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O10,pos_2_1proton1potassium,500.26214748,LTRLDPJSMLPKMF,Terpenoids,Apocarotenoids,Megastigmanes,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 3116,5311,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.0,MS1_match,MNTSOBLYWJLVEK-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-25(39-27(29)10-16)14-1-4-18(5-2-14)38-24-6-3-15(7-19(24)33)26-13-23(37)30-21(35)9-17(32)11-28(30)40-26/h1-13,31-35H",O=c1cc(-c2ccc(Oc3ccc(-c4cc(=O)c5c(O)cc(O)cc5o4)cc3O)cc2)oc2cc(O)cc(O)c12,C30H18O10,pos_1_1proton1methanol,538.089996776,MNTSOBLYWJLVEK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 3117,5311,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.0,MS1_match,NNPGECDACGBKDH-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-13,31-35H",O=c1cc(-c2ccc(Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O)cc2)oc2cc(O)cc(O)c12,C30H18O10,pos_1_1proton1methanol,538.0899967759999,NNPGECDACGBKDH,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 3118,5310,-1,,,,0.0,MS1_match,HSUIVCLOAAJSRE-UHFFFAOYSA-N,"InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3",COCCOC(=O)c1ccccc1C(=O)OCCOC,C14H18O6,pos_1_1proton1ammonium,282.110338296,HSUIVCLOAAJSRE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3119,5309,925,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-PXKJKYEHSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22+,23-,25-,26-,27+/m0/s1",CC(=O)OC[C@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_1_1proton1ammonium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 3120,5309,925,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-UHFFFAOYSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3",CC(=O)OCC1(O)C(O)CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C21,C27H42O12,pos_1_1proton1ammonium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 3121,5309,925,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-HXTWUXIJSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22-,23-,25-,26-,27-/m0/s1",CC(=O)OC[C@@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_1_1proton1ammonium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3122,5307,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1potassium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 3123,5304,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.4631064,ISDB,NCHUIUBVZLLXAJ-DDKCOJEUSA-N,"InChI=1S/C26H40O12/c1-13(8-10-27)5-4-6-14(2)23(33)35-12-17-19(28)20(29)21(30)25(37-17)38-24-18-15(7-9-26(18,3)34)16(11-36-24)22(31)32/h6,11,13,15,17-21,24-25,27-30,34H,4-5,7-10,12H2,1-3H3,(H,31,32)/b14-6+/t13-,15+,17+,18+,19+,20-,21+,24-,25-,26-/m0/s1",C/C(=C\CC[C@H](C)CCO)C(=O)OC[C@H]1O[C@@H](O[C@@H]2OC=C(C(=O)O)[C@H]3CC[C@](C)(O)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O,C26H40O12,,544.25197672,NCHUIUBVZLLXAJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Vitex agnus-castus,988127.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Vitex'],['Vitex agnus-castus'],4,2,6.852425575256348 3124,5301,-1,,,,0.34518754,ISDB,XDLKVPLICUIRQM-UZMFJTJZSA-N,"InChI=1S/C34H46O9/c1-9-17(2)31(37)43-25-14-24(41-19(4)35)32(5)16-40-28-29(32)33(25,6)23-13-26(38-8)42-22-12-21(20-10-11-39-15-20)18(3)27(22)34(23,7)30(28)36/h9-11,15,21-26,28-30,36H,12-14,16H2,1-8H3/b17-9+/t21-,22+,23-,24-,25+,26-,28-,29+,30-,32-,33+,34-/m1/s1",C/C=C(\C)C(=O)O[C@H]1C[C@@H](OC(C)=O)[C@@]2(C)CO[C@H]3[C@@H](O)[C@@]4(C)C5=C(C)[C@H](c6ccoc6)C[C@@H]5O[C@@H](OC)C[C@@H]4[C@]1(C)[C@@H]32,C34H46O9,,598.314183052,XDLKVPLICUIRQM,Terpenoids,Triterpenoids,Limonoids,Melia azedarach,916052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Melia'],['Melia azedarach'],4,0,5.3807501792907715 3125,5301,-1,,,,0.34518754,ISDB,XDLKVPLICUIRQM-PHHWVVQSSA-N,"InChI=1S/C34H46O9/c1-9-17(2)31(37)43-25-14-24(41-19(4)35)32(5)16-40-28-29(32)33(25,6)23-13-26(38-8)42-22-12-21(20-10-11-39-15-20)18(3)27(22)34(23,7)30(28)36/h9-11,15,21-26,28-30,36H,12-14,16H2,1-8H3/b17-9+/t21-,22-,23-,24-,25+,26-,28-,29+,30-,32-,33+,34-/m1/s1",C/C=C(\C)C(=O)O[C@H]1C[C@@H](OC(C)=O)[C@@]2(C)CO[C@H]3[C@@H](O)[C@@]4(C)C5=C(C)[C@H](c6ccoc6)C[C@H]5O[C@@H](OC)C[C@@H]4[C@]1(C)[C@@H]32,C34H46O9,,598.314183052,XDLKVPLICUIRQM,Terpenoids,Triterpenoids,Limonoids,Munronia pinnata,430634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Munronia'],['Munronia pinnata'],4,0,5.3807501792907715 3126,5297,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.24602444,ISDB,HIARXNDFUNZRAY-UHFFFAOYSA-N,"InChI=1S/C12H15NO6/c1-18-10(16)5-8-7(3-4-9(14)15)6-13-11(8)12(17)19-2/h6,13H,3-5H2,1-2H3,(H,14,15)",COC(=O)Cc1c(CCC(=O)O)c[nH]c1C(=O)OC,C12H15NO6,,269.0899372,HIARXNDFUNZRAY,,,,Monascus ruber,187724.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Monascaceae'],['Unknown'],['Monascus'],['Monascus ruber'],1,0,1.9840977787971497 3127,5295,-1,,,,0.0,MS1_match,LUDMVJVLHCEECS-PXKJKYEHSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22+,23-,25-,26-,27+/m0/s1",CC(=O)OC[C@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_1_sodium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3128,5295,-1,,,,0.0,MS1_match,LUDMVJVLHCEECS-UHFFFAOYSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3",CC(=O)OCC1(O)C(O)CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C21,C27H42O12,pos_1_sodium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,0,6.0 3129,5295,-1,,,,0.0,MS1_match,LUDMVJVLHCEECS-HXTWUXIJSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22-,23-,25-,26-,27-/m0/s1",CC(=O)OC[C@@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_1_sodium,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3130,5294,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.36561948,ISDB,SVQOEFMFPWOSRE-ZHYQWURXSA-N,"InChI=1S/C22H24O10/c1-9-19(26)20(27)21(28)22(30-9)31-11-6-13(24)18-14(25)8-16(32-17(18)7-11)10-3-4-15(29-2)12(23)5-10/h3-7,9,16,19-24,26-28H,8H2,1-2H3/t9-,16-,19-,20-,21+,22-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O,C22H24O10,,448.136946968,SVQOEFMFPWOSRE,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Cordia obliqua,97403.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Cordiaceae'],['Unknown'],['Cordia'],['Cordia myxa'],4,3,6.962477922439575 3131,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3132,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3133,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 3134,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 3135,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3136,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3137,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 3138,5292,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 3139,5292,-1,,,,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_sodium,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 3140,5292,-1,,,,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_sodium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3141,5292,-1,,,,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_sodium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 3142,5288,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.4769832,ISDB,WCOJTKTTYBPGPG-UHFFFAOYSA-N,"InChI=1S/C22H33BrO2/c1-17(8-4-9-18(2)11-7-15-23)10-5-12-19(3)21-16-20(21)13-6-14-22(24)25/h5,10,12,18-21H,4,6,8-9,11,13-14,16H2,1-3H3,(H,24,25)",CC(=CC=CC(C)C1CC1CCCC(=O)O)CCCC(C)CC#CBr,C22H33BrO2,,408.166392396,WCOJTKTTYBPGPG,Fatty acids,Fatty Acids and Conjugates,,Cladonia furcata,624792.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Cladoniaceae'],['Unknown'],['Cladonia'],['Cladonia furcata'],1,0,2.907932758331299 3143,5288,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.4769832,ISDB,WCOJTKTTYBPGPG-MUTMBXSBSA-N,"InChI=1S/C22H33BrO2/c1-17(8-4-9-18(2)11-7-15-23)10-5-12-19(3)21-16-20(21)13-6-14-22(24)25/h5,10,12,18-21H,4,6,8-9,11,13-14,16H2,1-3H3,(H,24,25)/b12-5+,17-10+/t18-,19+,20-,21+/m1/s1",C/C(=C\C=C\[C@H](C)[C@@H]1C[C@H]1CCCC(=O)O)CCC[C@@H](C)CC#CBr,C22H33BrO2,,408.166392396,WCOJTKTTYBPGPG,Fatty acids,Fatty Acids and Conjugates,,Cladonia furcata subsp. furcata,4064283.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Cladoniaceae'],['Unknown'],['Cladonia'],['Unknown'],1,0,2.907932758331299 3144,5284,214,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DWZAJFZEYZIHPO-UHFFFAOYSA-N,"InChI=1S/C18H16O7/c1-22-10-6-4-9(5-7-10)16-18(24-3)15(21)13-12(25-16)8-11(19)17(23-2)14(13)20/h4-8,19-20H,1-3H3",COc1ccc(-c2oc3cc(O)c(OC)c(O)c3c(=O)c2OC)cc1,C18H16O7,pos_1_1proton,344.089602852,DWZAJFZEYZIHPO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,3,7.5 3145,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-MQNNAEJASA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17-,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,3,7.5 3146,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 3147,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3",CC1OC(Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O,C21H20O10,pos_1_sodium,432.1056468399998,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 3148,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-MQNNAEJASA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17-,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,3,7.5 3149,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 3150,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3",CC1OC(Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O,C21H20O10,pos_1_sodium,432.1056468399998,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 3151,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,PMWOCSJXZDDAPR-IARDODDQSA-N,"InChI=1S/C21H20O10/c1-8(22)19-17(27)18(28)21(31-19)29-11-6-12(24)14-13(7-11)30-20(16(26)15(14)25)9-2-4-10(23)5-3-9/h2-8,17-19,21-24,26-28H,1H3/t8-,17-,18+,19+,21+/m0/s1",C[C@H](O)[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H]1O,C21H20O10,pos_1_sodium,432.1056468399998,PMWOCSJXZDDAPR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,3,7.5 3152,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,PMWOCSJXZDDAPR-IARDODDQSA-N,"InChI=1S/C21H20O10/c1-8(22)19-17(27)18(28)21(31-19)29-11-6-12(24)14-13(7-11)30-20(16(26)15(14)25)9-2-4-10(23)5-3-9/h2-8,17-19,21-24,26-28H,1H3/t8-,17-,18+,19+,21+/m0/s1",C[C@H](O)[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H]1O,C21H20O10,pos_1_sodium,432.1056468399998,PMWOCSJXZDDAPR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,3,7.5 3153,5279,510,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,OBPMSXUPNDBUII-GLYWERGQSA-N,"InChI=1S/C21H20O10/c1-8-15(24)20(28)31-21(16(8)25)29-11-6-12(23)14-13(7-11)30-19(18(27)17(14)26)9-2-4-10(22)5-3-9/h2-8,15-16,20-25,27-28H,1H3/t8-,15-,16-,20-,21-/m1/s1",C[C@@H]1[C@@H](O)[C@H](O)O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@@H]1O,C21H20O10,pos_1_sodium,432.10564684,OBPMSXUPNDBUII,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 3154,5277,214,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_2MH,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,1,7.5 3155,5274,-1,,,,0.0,MS1_match,GGFAHFSRIITJIJ-NONSRLQASA-N,"InChI=1S/C11H16O4/c1-6-3-4-7-8(10(12)14-2)5-15-11(13)9(6)7/h5-7,9,11,13H,3-4H2,1-2H3/t6-,7+,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@H]2[C@@H]1CC[C@@H]2C,C11H16O4,pos_1_1proton2acetonitrile,212.104858992,GGFAHFSRIITJIJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3156,5264,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XCXZPJYVZYGBQA-QKPADMPASA-N,"InChI=1S/C22H34O15/c1-6-9(24)2-7-8(19(31)32)4-33-20(12(6)7)37-22-18(30)16(28)14(26)11(36-22)5-34-21-17(29)15(27)13(25)10(3-23)35-21/h4,6-7,9-18,20-30H,2-3,5H2,1H3,(H,31,32)/t6-,7+,9-,10+,11+,12+,13+,14+,15-,16-,17+,18+,20-,21+,22-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C22H34O15,pos_1_1proton1ammonium,538.189770388,XCXZPJYVZYGBQA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 3157,5264,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XCXZPJYVZYGBQA-QKPADMPASA-N,"InChI=1S/C22H34O15/c1-6-9(24)2-7-8(19(31)32)4-33-20(12(6)7)37-22-18(30)16(28)14(26)11(36-22)5-34-21-17(29)15(27)13(25)10(3-23)35-21/h4,6-7,9-18,20-30H,2-3,5H2,1H3,(H,31,32)/t6-,7+,9-,10+,11+,12+,13+,14+,15-,16-,17+,18+,20-,21+,22-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C22H34O15,pos_1_1proton1ammonium,538.189770388,XCXZPJYVZYGBQA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 3158,5264,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XCXZPJYVZYGBQA-QKPADMPASA-N,"InChI=1S/C22H34O15/c1-6-9(24)2-7-8(19(31)32)4-33-20(12(6)7)37-22-18(30)16(28)14(26)11(36-22)5-34-21-17(29)15(27)13(25)10(3-23)35-21/h4,6-7,9-18,20-30H,2-3,5H2,1H3,(H,31,32)/t6-,7+,9-,10+,11+,12+,13+,14+,15-,16-,17+,18+,20-,21+,22-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C22H34O15,pos_1_1proton1ammonium,538.189770388,XCXZPJYVZYGBQA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus asperoides,589185.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asperoides'],6,3,7.5 3159,5261,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.21333252,ISDB,,,,,,,VSEIDKRSJSYZRQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8533300757408142 3160,5260,186,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KZNWWOXBZGCGSK-UHFFFAOYSA-N,"InChI=1S/C11H10O3/c1-13-5-9-6-14-7-11-8(4-12)2-3-10(9)11/h2-4,6-7H,5H2,1H3",COCc1cocc2c(C=O)ccc1-2,C11H10O3,pos_1_1proton1ammonium,190.06299418,KZNWWOXBZGCGSK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 3161,5253,348,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MK,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3162,5253,348,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MK,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3163,5253,348,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MK,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3164,5253,348,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MK,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3165,5253,348,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MK,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3166,5253,348,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MK,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3167,5252,964,Terpenoids,Steroids,Amarylidaceae alkaloids,0.0,MS1_match,NRWUTPXRYNUSMI-XOLXQSKQSA-N,"InChI=1S/C17H30O9/c1-7-8-4-11(19)17(2,9(8)6-24-15(7)23-3)26-16-14(22)13(21)12(20)10(5-18)25-16/h7-16,18-22H,4-6H2,1-3H3/t7-,8-,9+,10-,11-,12-,13+,14-,15-,16+,17+/m1/s1",CO[C@@H]1OC[C@H]2[C@H](C[C@@H](O)[C@@]2(C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1C,C17H30O9,pos_1_1proton2acetonitrile,378.18898254,NRWUTPXRYNUSMI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,1,6.5 3168,5251,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.4438941,ISDB,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,11.27557635307312 3169,5251,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.4438941,ISDB,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,3,11.27557635307312 3170,5247,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.46825996,ISDB,XLRKOLKRNKXOTP-WLUVJUPWSA-N,"InChI=1S/C26H38O12/c1-13(8-10-27)5-4-6-14(2)23(33)35-12-17-19(28)20(29)21(30)25(37-17)38-24-18-15(7-9-26(18,3)34)16(11-36-24)22(31)32/h6,8,11,15,17-21,24-25,27-30,34H,4-5,7,9-10,12H2,1-3H3,(H,31,32)/b13-8+,14-6+/t15-,17-,18-,19-,20+,21-,24+,25+,26+/m1/s1",C/C(=C\CO)CC/C=C(\C)C(=O)OC[C@H]1O[C@@H](O[C@@H]2OC=C(C(=O)O)[C@H]3CC[C@](C)(O)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O,C26H38O12,,542.236326656,XLRKOLKRNKXOTP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Vitex agnus-castus,988127.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Vitex'],['Vitex agnus-castus'],4,2,6.8730398416519165 3171,5243,-1,,,,0.0,MS1_match,RSFLKWAAFPCZOO-FNNJSYLVSA-N,"InChI=1S/C34H52O15/c1-18(2)11-25(37)47-28(20(5)6)30(40)43-15-23-16-44-31(48-26(38)12-19(3)4)29-33(23,41)13-24(46-21(7)35)34(29,42)17-45-27(39)14-32(9,10)49-22(8)36/h16,18-20,24,28-29,31,41-42H,11-15,17H2,1-10H3/t24-,28+,29-,31-,33-,34+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)(C)OC(C)=O,C34H52O15,pos_2_1proton1potassium,700.330620964,RSFLKWAAFPCZOO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3172,5243,-1,,,,0.0,MS1_match,RSFLKWAAFPCZOO-YXIIQOEFSA-N,"InChI=1S/C34H52O15/c1-18(2)11-25(37)47-28(20(5)6)30(40)43-15-23-16-44-31(48-26(38)12-19(3)4)29-33(23,41)13-24(46-21(7)35)34(29,42)17-45-27(39)14-32(9,10)49-22(8)36/h16,18-20,24,28-29,31,41-42H,11-15,17H2,1-10H3/t24-,28?,29-,31-,33-,34+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)(C)OC(C)=O,C34H52O15,pos_2_1proton1potassium,700.3306209639999,RSFLKWAAFPCZOO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3173,5243,-1,,,,0.0,MS1_match,RSFLKWAAFPCZOO-FNNJSYLVSA-N,"InChI=1S/C34H52O15/c1-18(2)11-25(37)47-28(20(5)6)30(40)43-15-23-16-44-31(48-26(38)12-19(3)4)29-33(23,41)13-24(46-21(7)35)34(29,42)17-45-27(39)14-32(9,10)49-22(8)36/h16,18-20,24,28-29,31,41-42H,11-15,17H2,1-10H3/t24-,28+,29-,31-,33-,34+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)(C)OC(C)=O,C34H52O15,pos_2_1proton1potassium,700.330620964,RSFLKWAAFPCZOO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3174,5243,-1,,,,0.0,MS1_match,RSFLKWAAFPCZOO-YXIIQOEFSA-N,"InChI=1S/C34H52O15/c1-18(2)11-25(37)47-28(20(5)6)30(40)43-15-23-16-44-31(48-26(38)12-19(3)4)29-33(23,41)13-24(46-21(7)35)34(29,42)17-45-27(39)14-32(9,10)49-22(8)36/h16,18-20,24,28-29,31,41-42H,11-15,17H2,1-10H3/t24-,28?,29-,31-,33-,34+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)(C)OC(C)=O,C34H52O15,pos_2_1proton1potassium,700.3306209639999,RSFLKWAAFPCZOO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3175,5240,-1,,,,0.0,MS1_match,UBQCFEASTTXIKB-UHFFFAOYSA-N,"InChI=1S/C27H28N2O4/c1-20(30)28-24(17-21-11-5-2-6-12-21)19-33-27(32)25(18-22-13-7-3-8-14-22)29-26(31)23-15-9-4-10-16-23/h2-16,24-25H,17-19H2,1H3,(H,28,30)(H,29,31)",CC(=O)NC(COC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1)Cc1ccccc1,C27H28N2O4,pos_1_1proton1ethylamine,444.204907376,UBQCFEASTTXIKB,Amino acids and Peptides,Small peptides,Dipeptides,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 3176,5238,1459,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,0.21686122,ISDB,,,,,,,WISFBGZZZDIQKY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8674448728561401 3177,5234,972,Terpenoids,Apocarotenoids,Pyridine alkaloids,0.0,MS1_match,LTRLDPJSMLPKMF-YKXWAFRCSA-N,"InChI=1S/C25H40O10/c1-12-9-14(26)10-25(3,4)15(12)6-5-13(2)34-24-23(32)22(31)21(30)18(35-24)11-33-17-8-7-16(27)19(28)20(17)29/h5-6,9,13,15-24,27-32H,7-8,10-11H2,1-4H3/b6-5+/t13-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2CC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O10,pos_2_1proton1potassium,500.26214748,LTRLDPJSMLPKMF,Terpenoids,Apocarotenoids,Megastigmanes,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,8.0 3178,5231,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.4971857,ISDB,DZNQMARSUVZEMD-VHKGBJFMSA-N,"InChI=1S/C21H34O3/c1-19(13-22)8-4-9-20(2)16(19)7-10-21-11-14(5-6-17(20)21)15(12-21)18(23)24-3/h14-17,22H,4-13H2,1-3H3/t14-,15-,16-,17+,19+,20-,21+/m1/s1",COC(=O)[C@@H]1C[C@@]23CC[C@@H]4[C@](C)(CO)CCC[C@@]4(C)[C@@H]2CC[C@@H]1C3,C21H34O3,,334.250794948,DZNQMARSUVZEMD,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Baccharis minutiflora,7600036.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Baccharis'],['Baccharis minutiflora'],4,3,7.488742828369141 3179,5231,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.4971857,ISDB,DZNQMARSUVZEMD-VHKGBJFMSA-N,"InChI=1S/C21H34O3/c1-19(13-22)8-4-9-20(2)16(19)7-10-21-11-14(5-6-17(20)21)15(12-21)18(23)24-3/h14-17,22H,4-13H2,1-3H3/t14-,15-,16-,17+,19+,20-,21+/m1/s1",COC(=O)[C@@H]1C[C@@]23CC[C@@H]4[C@](C)(CO)CCC[C@@]4(C)[C@@H]2CC[C@@H]1C3,C21H34O3,,334.250794948,DZNQMARSUVZEMD,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Beyeria leschenaultii,526463.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Ricinocarpeae'],['Beyeria'],['Beyeria leschenaultii'],4,3,7.488742828369141 3180,5231,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.4971857,ISDB,DZNQMARSUVZEMD-CRBQNXBKSA-N,"InChI=1S/C21H34O3/c1-19(13-22)8-4-9-20(2)16(19)7-10-21-11-14(5-6-17(20)21)15(12-21)18(23)24-3/h14-17,22H,4-13H2,1-3H3/t14-,15-,16+,17-,19+,20-,21+/m1/s1",COC(=O)[C@@H]1C[C@@]23CC[C@H]4[C@](C)(CO)CCC[C@@]4(C)[C@H]2CC[C@@H]1C3,C21H34O3,,334.250794948,DZNQMARSUVZEMD,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Annona senegalensis,546788.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona senegalensis'],4,3,7.488742828369141 3181,5229,-1,,,,0.0,MS1_match,LTRLDPJSMLPKMF-YKXWAFRCSA-N,"InChI=1S/C25H40O10/c1-12-9-14(26)10-25(3,4)15(12)6-5-13(2)34-24-23(32)22(31)21(30)18(35-24)11-33-17-8-7-16(27)19(28)20(17)29/h5-6,9,13,15-24,27-32H,7-8,10-11H2,1-4H3/b6-5+/t13-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2CC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O10,pos_1_1proton1methanol,500.26214748,LTRLDPJSMLPKMF,Terpenoids,Apocarotenoids,Megastigmanes,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 3182,5223,377,Polyketides,Aromatic polyketides,Catechols with side chains,0.3956951,ISDB,ZWERVKPIXLXNTP-YXDDMCJOSA-N,"InChI=1S/C30H48O8/c1-3-21(2)25(37-30-29(36)28(35)27(34)26(20-31)38-30)16-14-12-10-8-6-4-5-7-9-11-13-15-22-17-23(32)19-24(33)18-22/h5,7,9,11,17-19,21,25-36H,3-4,6,8,10,12-16,20H2,1-2H3/b7-5+,11-9+/t21-,25+,26+,27+,28-,29+,30-/m0/s1",CC[C@H](C)[C@@H](CCCCCCC/C=C/C=C/CCc1cc(O)cc(O)c1)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C30H48O8,,536.3349184959998,ZWERVKPIXLXNTP,Polyketides,Aromatic polyketides,Depsides,Penicillium simplicissimum,968742.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium simplicissimum'],1,2,3.582780361175537 3183,5223,377,Polyketides,Aromatic polyketides,Catechols with side chains,0.3956951,ISDB,ZWERVKPIXLXNTP-YXDDMCJOSA-N,"InChI=1S/C30H48O8/c1-3-21(2)25(37-30-29(36)28(35)27(34)26(20-31)38-30)16-14-12-10-8-6-4-5-7-9-11-13-15-22-17-23(32)19-24(33)18-22/h5,7,9,11,17-19,21,25-36H,3-4,6,8,10,12-16,20H2,1-2H3/b7-5+,11-9+/t21-,25+,26+,27+,28-,29+,30-/m0/s1",CC[C@H](C)[C@@H](CCCCCCC/C=C/C=C/CCc1cc(O)cc(O)c1)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C30H48O8,,536.3349184959998,ZWERVKPIXLXNTP,Polyketides,Aromatic polyketides,Depsides,Penicillium janthinellum,226477.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium janthinellum'],1,2,3.582780361175537 3184,5223,377,Polyketides,Aromatic polyketides,Catechols with side chains,0.3956951,ISDB,ZWERVKPIXLXNTP-YXDDMCJOSA-N,"InChI=1S/C30H48O8/c1-3-21(2)25(37-30-29(36)28(35)27(34)26(20-31)38-30)16-14-12-10-8-6-4-5-7-9-11-13-15-22-17-23(32)19-24(33)18-22/h5,7,9,11,17-19,21,25-36H,3-4,6,8,10,12-16,20H2,1-2H3/b7-5+,11-9+/t21-,25+,26+,27+,28-,29+,30-/m0/s1",CC[C@H](C)[C@@H](CCCCCCC/C=C/C=C/CCc1cc(O)cc(O)c1)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C30H48O8,,536.3349184959998,ZWERVKPIXLXNTP,Polyketides,Aromatic polyketides,Depsides,Penicillium ianthinellum,82948.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium ianthinellum'],1,2,3.582780361175537 3185,5221,-1,,,,0.26319358,ISDB,PGPDKMQOQDXHAJ-XORKOADCSA-N,"InChI=1S/C28H36O14/c1-36-18-8-5-16(11-19(18)37-2)25(34)40-13-28(35)14-41-27(24(28)33)39-12-20-21(30)22(31)23(32)26(42-20)38-10-9-15-3-6-17(29)7-4-15/h3-8,11,20-24,26-27,29-33,35H,9-10,12-14H2,1-2H3/t20-,21-,22+,23-,24+,26-,27-,28-/m1/s1",COc1ccc(C(=O)OC[C@@]2(O)CO[C@@H](OC[C@H]3O[C@@H](OCCc4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1OC,C28H36O14,,596.210505832,PGPDKMQOQDXHAJ,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Handroanthus impetiginosum,532896.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Unknown'],['Handroanthus'],['Handroanthus impetiginosus'],4,0,5.0527743101119995 3186,5221,-1,,,,0.26319358,ISDB,PGPDKMQOQDXHAJ-XORKOADCSA-N,"InChI=1S/C28H36O14/c1-36-18-8-5-16(11-19(18)37-2)25(34)40-13-28(35)14-41-27(24(28)33)39-12-20-21(30)22(31)23(32)26(42-20)38-10-9-15-3-6-17(29)7-4-15/h3-8,11,20-24,26-27,29-33,35H,9-10,12-14H2,1-2H3/t20-,21-,22+,23-,24+,26-,27-,28-/m1/s1",COc1ccc(C(=O)OC[C@@]2(O)CO[C@@H](OC[C@H]3O[C@@H](OCCc4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1OC,C28H36O14,,596.210505832,PGPDKMQOQDXHAJ,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Handroanthus impetiginosus,532896.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Unknown'],['Handroanthus'],['Handroanthus impetiginosus'],4,0,5.0527743101119995 3187,5219,38,Terpenoids,Steroids,Cholestane steroids,0.6008089,ISDB,GQVCGTRDXSDAHC-UHFFFAOYSA-N,"InChI=1S/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3",COC1C=C2C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC2C2(C)CCC(O)CC12O,C29H48O3,,444.360345396,GQVCGTRDXSDAHC,Terpenoids,Steroids,Cholestane steroids,Trewia nudiflora,375532.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus nudiflorus'],4,3,7.903235673904419 3188,5219,38,Terpenoids,Steroids,Cholestane steroids,0.6008089,ISDB,GQVCGTRDXSDAHC-DDUFMXSOSA-N,"InChI=1S/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24-,25-,26-,27+,28+,29-/m0/s1",CO[C@H]1C=C2[C@@H]3CC[C@H]([C@H](C)/C=C/[C@H](C)C(C)C)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC[C@H](O)C[C@]12O,C29H48O3,,444.360345396,GQVCGTRDXSDAHC,Terpenoids,Steroids,Cholestane steroids,Mallotus nudiflorus,375532.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus nudiflorus'],4,3,7.903235673904419 3189,5216,-1,,,,0.0,MS1_match,IUCHKMAZAWJNBJ-RCYXVVTDSA-N,"InChI=1S/C36H56O9/c1-31(2)14-16-36(30(42)43)17-15-34(6)19(20(36)18-31)8-9-22-33(5)12-11-23(32(3,4)21(33)10-13-35(22,34)7)44-29-26(39)24(37)25(38)27(45-29)28(40)41/h8,20-27,29,37-39H,9-18H2,1-7H3,(H,40,41)(H,42,43)/t20-,21-,22+,23-,24-,25-,26+,27-,29+,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O9,pos_1_1proton1dmso,632.392433372,IUCHKMAZAWJNBJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,0,7.0 3190,5215,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.5001447,ISDB,GKYPZOXWYQBEPK-IBKSRVHKSA-N,"InChI=1S/C25H30O13/c1-2-13-14(7-8-26)15(23(33)34)11-35-24(13)38-25-22(21(32)20(31)18(10-27)36-25)37-19(30)6-4-12-3-5-16(28)17(29)9-12/h2-6,9,11,13-14,18,20-22,24-29,31-32H,1,7-8,10H2,(H,33,34)/b6-4+/t13-,14+,18-,20-,21+,22-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)/C=C/c2ccc(O)c(O)c2)OC=C(C(=O)O)[C@H]1CCO,C25H30O13,,538.16864102,GKYPZOXWYQBEPK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Chiococca alba,1069775.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Chiococceae'],['Chiococca'],['Chiococca alba'],4,3,7.500578880310059 3191,5214,-1,,,,0.0,MS1_match,AHBAQZQLKMGGRP-QAUKJAHTSA-N,"InChI=1S/C25H34O6/c1-13(2)16-6-8-18(17-7-5-14(3)19(17)9-16)23(27)31-12-25(29)21(26)10-20-15(4)11-30-24(28)22(20)25/h6,8,13-14,17,19-22,26,29H,4-5,7,9-12H2,1-3H3/t14-,17-,19-,20+,21+,22+,25+/m1/s1",C=C1COC(=O)[C@@H]2[C@H]1C[C@H](O)[C@@]2(O)COC(=O)C1=CC=C(C(C)C)C[C@@H]2[C@H](C)CC[C@H]12,C25H34O6,pos_1_1proton1isopropanol,430.2355388079999,AHBAQZQLKMGGRP,Terpenoids,Diterpenoids,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3192,5208,-1,,,,0.0,MS1_match,OJOKJVGGOVOIJJ-MRVPVSSYSA-N,"InChI=1S/C11H16O3/c1-7-4-11(13)9(6-10(7)12)5-8(2)14-3/h4,6,8,12-13H,5H2,1-3H3/t8-/m1/s1",CO[C@H](C)Cc1cc(O)c(C)cc1O,C11H16O3,pos_2MK,196.109944372,OJOKJVGGOVOIJJ,Polyketides,Aromatic polyketides,Simple aromatic polyketides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 3193,5208,-1,,,,0.0,MS1_match,XEVQXKKKAVVSMW-CPCISQLKSA-N,"InChI=1S/C11H16O3/c1-10(2)5-7(12)6-11(3)8(10)4-9(13)14-11/h4,7,12H,5-6H2,1-3H3/t7-,11-/m0/s1",CC1(C)C[C@H](O)C[C@]2(C)OC(=O)C=C12,C11H16O3,pos_2MK,196.109944372,XEVQXKKKAVVSMW,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Monteverdia apurimacensis,5750133.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia apurimacensis'],6,0,6.0 3194,5208,-1,,,,0.0,MS1_match,VMQAMBIFNUSHAN-WRWORJQWSA-N,"InChI=1S/C11H16O3/c1-10(2)5-7-6-11(3,13)8(12)4-9(10)14-7/h4,7,13H,5-6H2,1-3H3/t7-,11+/m0/s1",CC1(C)C[C@H]2C[C@@](C)(O)C(=O)C=C1O2,C11H16O3,pos_2MK,196.109944372,VMQAMBIFNUSHAN,Terpenoids,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3195,5208,-1,,,,0.0,MS1_match,VMQAMBIFNUSHAN-WRWORJQWSA-N,"InChI=1S/C11H16O3/c1-10(2)5-7-6-11(3,13)8(12)4-9(10)14-7/h4,7,13H,5-6H2,1-3H3/t7-,11+/m0/s1",CC1(C)C[C@H]2C[C@@](C)(O)C(=O)C=C1O2,C11H16O3,pos_2MK,196.109944372,VMQAMBIFNUSHAN,Terpenoids,,,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.0 3196,5204,585,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KLQIXIQHWLZXBE-CWDKFGSUSA-N,"InChI=1S/C23H30O8/c1-6-14(4)8-20(26)30-18-9-17-16(10-27-15(5)24)11-28-22(21(17)23(18)12-29-23)31-19(25)7-13(2)3/h7,9,11,14,18,21-22H,6,8,10,12H2,1-5H3/t14-,18-,21+,22-,23+/m0/s1",CC[C@H](C)CC(=O)O[C@H]1C=C2C(COC(C)=O)=CO[C@@H](OC(=O)C=C(C)C)[C@@H]2[C@@]12CO2,C23H30O8,pos_1_1proton1ammonium,434.19406792,KLQIXIQHWLZXBE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 3197,5200,-1,,,,0.34499055,ISDB,MXTCKNHXBBXULO-ZJDHVTHPSA-N,"InChI=1S/C20H26O2/c1-14-12-17(21)18-19(2,3)9-5-10-20(18,4)16(14)7-6-15-8-11-22-13-15/h6-8,11-13,16,18H,5,9-10H2,1-4H3/b7-6+/t16-,18-,20+/m0/s1",CC1=CC(=O)[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1/C=C/c1ccoc1,C20H26O2,,298.193280072,MXTCKNHXBBXULO,Terpenoids,Diterpenoids,Labdane diterpenoids,Hedychium spicatum,750971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Hedychium'],['Hedychium spicatum'],4,0,5.379962205886841 3198,5200,-1,,,,0.34499055,ISDB,MXTCKNHXBBXULO-UHFFFAOYSA-N,"InChI=1S/C20H26O2/c1-14-12-17(21)18-19(2,3)9-5-10-20(18,4)16(14)7-6-15-8-11-22-13-15/h6-8,11-13,16,18H,5,9-10H2,1-4H3",CC1=CC(=O)C2C(C)(C)CCCC2(C)C1C=Cc1ccoc1,C20H26O2,,298.193280072,MXTCKNHXBBXULO,Terpenoids,Diterpenoids,Labdane diterpenoids,Hedychium yunnanense,801623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Hedychium'],['Hedychium yunnanense'],4,0,5.379962205886841 3199,5200,-1,,,,0.34499055,ISDB,MXTCKNHXBBXULO-ZJDHVTHPSA-N,"InChI=1S/C20H26O2/c1-14-12-17(21)18-19(2,3)9-5-10-20(18,4)16(14)7-6-15-8-11-22-13-15/h6-8,11-13,16,18H,5,9-10H2,1-4H3/b7-6+/t16-,18-,20+/m0/s1",CC1=CC(=O)[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1/C=C/c1ccoc1,C20H26O2,,298.193280072,MXTCKNHXBBXULO,Terpenoids,Diterpenoids,Labdane diterpenoids,Hedychium coronarium,161159.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Hedychium'],['Hedychium coronarium'],4,0,5.379962205886841 3200,5196,-1,,,,0.5824503,ISDB,ROTRZDNJZBPLJO-MLONCLLVSA-N,"InChI=1S/C19H34O7/c1-10-5-8-14(21)19(3,4)12(10)7-6-11(2)25-18-17(24)16(23)15(22)13(9-20)26-18/h11,13-18,20-24H,5-9H2,1-4H3/t11-,13-,14-,15-,16+,17-,18-/m1/s1",CC1=C(CC[C@@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H](O)CC1,C19H34O7,,374.230453428,ROTRZDNJZBPLJO,Terpenoids,Apocarotenoids,Megastigmanes,Alangium platanifolium,414781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Cornaceae'],['Unknown'],['Alangium'],['Alangium platanifolium'],4,0,6.329801082611084 3201,5188,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3202,5188,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3203,5185,-1,,,,0.4265367,ISDB,ARLNCELWGQDJPO-QDTXCPDVSA-N,"InChI=1S/C19H33NO/c1-2-3-4-5-6-7-8-9-10-11-13-16-19(21)20-17-14-12-15-18-20/h10-11,13,16H,2-9,12,14-15,17-18H2,1H3/b11-10+,16-13+",CCCCCCCCC/C=C/C=C/C(=O)N1CCCCC1,C19H33NO,,291.256214676,ARLNCELWGQDJPO,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Otanthus maritimus,195139.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Otanthus'],['Otanthus maritimus'],4,0,5.706146836280823 3204,5181,-1,,,,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2sodium,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,0,6.0 3205,5181,-1,,,,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2sodium,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,0,6.0 3206,5181,-1,,,,0.0,MS1_match,MLWDGPFGTFOLRJ-CUVHLRMHSA-N,"InChI=1S/C28H32O14/c1-11-21(32)23(34)25(36)27(38-11)42-26-24(35)22(33)19(10-29)41-28(26)39-14-7-15(30)20-16(31)9-17(40-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-30,32-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2sodium,592.179205704,MLWDGPFGTFOLRJ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,0,6.0 3207,5177,597,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_sodium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 3208,5177,597,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_sodium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 3209,5177,597,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_sodium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 3210,5177,597,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_sodium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 3211,5177,597,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UREPCGRALLQPJF-CTVCQPQISA-N,"InChI=1S/C27H30O14/c1-9(28)22-18(33)20(35)26(39-22)37-13-7-14(31)16-15(8-13)38-24(11-3-5-12(30)6-4-11)25(17(16)32)41-27-21(36)19(34)23(40-27)10(2)29/h3-10,18-23,26-31,33-36H,1-2H3/t9-,10-,18-,19+,20+,21-,22+,23-,26+,27+/m0/s1",C[C@H](O)[C@@H]1O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@H]([C@H](C)O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)[C@@H](O)[C@H]1O,C27H30O14,pos_1_sodium,578.1635556399999,UREPCGRALLQPJF,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,3,7.5 3212,5177,597,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UREPCGRALLQPJF-CTVCQPQISA-N,"InChI=1S/C27H30O14/c1-9(28)22-18(33)20(35)26(39-22)37-13-7-14(31)16-15(8-13)38-24(11-3-5-12(30)6-4-11)25(17(16)32)41-27-21(36)19(34)23(40-27)10(2)29/h3-10,18-23,26-31,33-36H,1-2H3/t9-,10-,18-,19+,20+,21-,22+,23-,26+,27+/m0/s1",C[C@H](O)[C@@H]1O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@H]([C@H](C)O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)[C@@H](O)[C@H]1O,C27H30O14,pos_1_sodium,578.1635556399999,UREPCGRALLQPJF,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,3,7.5 3213,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Menispermum dauricum,855369.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Menispermeae'],['Menispermum'],['Menispermum dauricum'],0,3,3.692467212677002 3214,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver arenarium,5727880.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver arenarium'],0,3,3.692467212677002 3215,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis ternata,7591082.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis ternata'],0,3,3.692467212677002 3216,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver armeniacum,605764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver armeniacum'],0,3,3.692467212677002 3217,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver fugax,6130809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver fugax'],0,3,3.692467212677002 3218,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis meifolia,5727943.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis meifolia'],0,3,3.692467212677002 3219,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver somniferum,438118.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver somniferum'],0,3,3.692467212677002 3220,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver macrostomum,84036.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver macrostomum'],0,3,3.692467212677002 3221,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis gortschakovii,5728011.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis gortschakovii'],0,3,3.692467212677002 3222,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver bracteatum,237538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver bracteatum'],0,3,3.692467212677002 3223,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver triniifolium,8381.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver triniifolium'],0,3,3.692467212677002 3224,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Lamprocapnos spectabilis,928569.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Lamprocapnos'],['Lamprocapnos spectabilis'],0,3,3.692467212677002 3225,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Meconopsis cambrica,542241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Meconopsis'],['Meconopsis cambrica'],0,3,3.692467212677002 3226,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis,438103.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Unknown'],0,3,3.692467212677002 3227,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Dactylicapnos torulosa,667819.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Dactylicapnos'],['Dactylicapnos torulosa'],0,3,3.692467212677002 3228,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Fumaria densiflora,793787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Fumaria'],['Fumaria densiflora'],0,3,3.692467212677002 3229,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis cornuta,6130333.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis cornuta'],0,3,3.692467212677002 3230,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis ophiocarpa,23592.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis ophiocarpa'],0,3,3.692467212677002 3231,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis gigantea,5727959.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis gigantea'],0,3,3.692467212677002 3232,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis bulleyana,5727972.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis bulleyana'],0,3,3.692467212677002 3233,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis saxicola,345836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis saxicola'],0,3,3.692467212677002 3234,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Argemone ochroleuca,266404.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Argemone'],['Argemone ochroleuca'],0,3,3.692467212677002 3235,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Fumaria parviflora,3944888.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Fumaria'],['Fumaria parviflora'],0,3,3.692467212677002 3236,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Fumaria officinalis,76888.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Fumaria'],['Fumaria officinalis'],0,3,3.692467212677002 3237,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Fumaria vaillantii,667812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Fumaria'],['Fumaria vaillantii'],0,3,3.692467212677002 3238,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Fumaria judaica,5503537.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Fumaria'],['Fumaria judaica'],0,3,3.692467212677002 3239,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-UHFFFAOYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)CC21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Argemone mexicana,408476.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Argemone'],['Argemone mexicana'],0,3,3.692467212677002 3240,5176,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.5481168,ISDB,MKRKFSHHTKVRAR-HNNXBMFYSA-N,"InChI=1S/C19H19NO4/c1-22-18-8-13-12(7-16(18)21)4-5-20-9-14-11(6-15(13)20)2-3-17-19(14)24-10-23-17/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1",COc1cc2c(cc1O)CCN1Cc3c(ccc4c3OCO4)C[C@@H]21,C19H19NO4,,325.131408088,MKRKFSHHTKVRAR,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Corydalis caucasica,5727948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis caucasica'],0,3,3.692467212677002 3241,5175,-1,,,,0.0,MS1_match,HYPGAWDRWVQHEX-UHFFFAOYSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(15(22)23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2",O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)OC(CO)C(O)C1O,C15H18O9,pos_1_1proton,342.095082156,HYPGAWDRWVQHEX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 3242,5175,-1,,,,0.0,MS1_match,HYPGAWDRWVQHEX-UHFFFAOYSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(15(22)23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2",O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)OC(CO)C(O)C1O,C15H18O9,pos_1_1proton,342.095082156,HYPGAWDRWVQHEX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 3243,5172,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.0,MS1_match,HADOPAZPQPTQTQ-LMOGBVFGSA-N,"InChI=1S/C20H32O3/c1-17-7-3-8-20(16(21)23-12-17)14(17)6-9-19-10-13(4-5-15(19)20)18(2,22)11-19/h13-16,21-22H,3-12H2,1-2H3/t13-,14-,15-,16-,17+,18-,19+,20+/m1/s1",C[C@]12CCC[C@]3([C@H](O)OC1)[C@@H]2CC[C@@]12C[C@@H](CC[C@H]13)[C@](C)(O)C2,C20H32O3,pos_1_1proton1methanol,320.235144884,HADOPAZPQPTQTQ,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 3244,5170,1073,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.5710139,ISDB,DHMCGPVUHSTCIP-UHFFFAOYSA-N,"InChI=1S/C14H17NO4/c1-9(2)7-15-13(17)4-3-10-5-11(16)14-12(6-10)18-8-19-14/h3-6,9,16H,7-8H2,1-2H3,(H,15,17)",CC(C)CNC(=O)C=Cc1cc(O)c2c(c1)OCO2,C14H17NO4,,263.115758024,DHMCGPVUHSTCIP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Zanthoxylum heitzii,6125670.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum heitzii'],4,2,7.284055709838867 3245,5165,1037,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VJPHRAFHYZGASA-FLPVFDBPSA-N,"InChI=1S/C25H36O10/c1-7-15(4)9-22(29)35-24-23-19(18(12-32-24)11-31-16(5)26)10-20(34-21(28)8-14(2)3)25(23,30)13-33-17(6)27/h10,12,14-15,20,23-24,30H,7-9,11,13H2,1-6H3/t15-,20+,23-,24+,25-/m0/s1",CC[C@H](C)CC(=O)O[C@H]1OC=C(COC(C)=O)C2=C[C@@H](OC(=O)CC(C)C)[C@@](O)(COC(C)=O)[C@@H]21,C25H36O10,pos_1_1proton2acetonitrile,496.230847352,VJPHRAFHYZGASA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 3246,5165,1037,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWGCPLJQSZLBJE-JEORNDINSA-N,"InChI=1S/C25H36O10/c1-7-14(4)8-20(28)35-24-21-18(9-19(33-15(5)26)25(21)12-32-25)17(11-31-24)10-30-23(29)22(13(2)3)34-16(6)27/h11,13-14,18-19,21-22,24H,7-10,12H2,1-6H3/t14-,18+,19-,21+,22+,24-,25+/m0/s1",CC[C@H](C)CC(=O)O[C@@H]1OC=C(COC(=O)[C@H](OC(C)=O)C(C)C)[C@H]2C[C@H](OC(C)=O)[C@]3(CO3)[C@@H]12,C25H36O10,pos_1_1proton2acetonitrile,496.230847352,GWGCPLJQSZLBJE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 3247,5164,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3248,5164,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3249,5162,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton1methanol,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 3250,5156,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BIWLELKAFXRPDE-UHFFFAOYSA-N,"InChI=1S/C40H60/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-16,19-22,25-30H,13-14,17-18,23-24,31-32H2,1-10H3",CC(C)=CCCC(C)=CCCC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)CCC=C(C)CCC=C(C)C,C40H60,pos_2_2proton,540.46950192,BIWLELKAFXRPDE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 3251,5155,-1,,,,0.23757531,ISDB,HYYCBNZMVDXFIO-MRLUPLGUSA-N,"InChI=1S/C31H47N7O6/c1-19(2)8-5-9-21(39)17-27(40)36-25(16-20-18-35-23-11-4-3-10-22(20)23)29(42)38-15-7-13-26(38)28(41)37-24(30(43)44)12-6-14-34-31(32)33/h3-4,10-11,18-19,21,24-26,35,39H,5-9,12-17H2,1-2H3,(H,36,40)(H,37,41)(H,43,44)(H4,32,33,34)/t21-,24-,25+,26-/m0/s1",CC(C)CCC[C@H](O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,C31H47N7O6,,613.358782224,HYYCBNZMVDXFIO,,,,Elysia rufescens,639897.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Gastropoda'],['Sacoglossa'],['Plakobranchidae'],['Unknown'],['Elysia'],['Elysia rufescens'],1,0,1.9503012299537659 3252,5154,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.34936988,ISDB,SJBXTBSLCWEDAI-NQORWKKUSA-N,"InChI=1S/C26H32O11/c1-26(32)11-10-15-16(23(31)33-2)13-34-24(19(15)26)37-25-22(21(30)20(29)17(12-27)35-25)36-18(28)9-8-14-6-4-3-5-7-14/h3-9,13,15,17,19-22,24-25,27,29-30,32H,10-12H2,1-2H3/b9-8+/t15-,17-,19-,20-,21+,22-,24+,25+,26+/m1/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)/C=C/c2ccccc2)[C@H]2[C@@H]1CC[C@]2(C)O,C26H32O11,,520.194461844,SJBXTBSLCWEDAI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Avicennia marina,77591.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Acanthaceae'],['Unknown'],['Avicennia'],['Avicennia marina'],4,0,5.39747953414917 3253,5153,-1,,,,0.22921485,ISDB,DAGSQWZZMKIIOU-YECZKKJWSA-N,"InChI=1S/C16H30O8/c1-5-16(4,22)7-6-10(18)15(2,3)24-14-13(21)12(20)11(19)9(8-17)23-14/h5,9-14,17-22H,1,6-8H2,2-4H3/t9-,10+,11-,12+,13-,14+,16+/m1/s1",C=C[C@](C)(O)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H30O8,,350.19406792,DAGSQWZZMKIIOU,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Diplospora dubia,729058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora dubia'],4,0,4.91685938835144 3254,5153,-1,,,,0.22921485,ISDB,DAGSQWZZMKIIOU-NBGILSABSA-N,"InChI=1S/C16H30O8/c1-5-16(4,22)7-6-10(18)15(2,3)24-14-13(21)12(20)11(19)9(8-17)23-14/h5,9-14,17-22H,1,6-8H2,2-4H3/t9-,10+,11-,12+,13-,14+,16-/m1/s1",C=C[C@@](C)(O)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H30O8,,350.19406792,DAGSQWZZMKIIOU,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Solenostemma argel,779101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Solenostemma'],['Solenostemma argel'],4,0,4.91685938835144 3255,5153,-1,,,,0.22921485,ISDB,DAGSQWZZMKIIOU-NBGILSABSA-N,"InChI=1S/C16H30O8/c1-5-16(4,22)7-6-10(18)15(2,3)24-14-13(21)12(20)11(19)9(8-17)23-14/h5,9-14,17-22H,1,6-8H2,2-4H3/t9-,10+,11-,12+,13-,14+,16-/m1/s1",C=C[C@@](C)(O)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H30O8,,350.19406792,DAGSQWZZMKIIOU,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Solenostemma oleifolium,6064974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Solenostemma'],['Solenostemma arghel'],4,0,4.91685938835144 3256,5152,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3257,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,0,7.0 3258,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,0,7.0 3259,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3260,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 3261,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3262,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3263,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3264,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,0,7.0 3265,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3266,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 3267,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3268,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3269,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3270,5152,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,0,7.0 3271,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 3272,5152,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3273,5152,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3274,5152,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3275,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3276,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 3277,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 3278,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_sodium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3279,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 3280,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 3281,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_sodium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3282,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3283,5152,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 3284,5151,566,Terpenoids,Monoterpenoids,Camphane monoterpenoids,0.24411465,ISDB,OCDWKDASQKOTIQ-UHFFFAOYSA-N,"InChI=1S/C16H28O7/c1-15-4-3-8(16(15,2)7-18)5-10(15)23-14-13(21)12(20)11(19)9(6-17)22-14/h8-14,17-21H,3-7H2,1-2H3",CC1(CO)C2CCC1(C)C(OC1OC(CO)C(O)C(O)C1O)C2,C16H28O7,,332.183503236,OCDWKDASQKOTIQ,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.476458609104156 3285,5150,731,Alkaloids,Lignans,Furofuranoid lignans,0.0,MS1_match,DRAPQDCEBKBPQE-ACFZRETJSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(13-4-6-16(29)18(8-13)34-2)26(14,11-36-23)38-25-22(32)21(31)20(30)19(9-27)37-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25+,26-/m1/s1",COc1cc([C@H]2OC[C@]3(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639999,DRAPQDCEBKBPQE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3286,5150,731,Alkaloids,Lignans,Furofuranoid lignans,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3287,5150,731,Alkaloids,Lignans,Furofuranoid lignans,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3288,5150,731,Alkaloids,Lignans,Furofuranoid lignans,0.0,MS1_match,GQLQVPZSTWXDBQ-ZOKOZUFBSA-N,"InChI=1S/C26H32O12/c1-33-17-8-13(3-5-15(17)28)24-26(32)11-36-23(14(26)10-35-24)12-4-6-16(18(7-12)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25-,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639998,GQLQVPZSTWXDBQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 3289,5150,731,Alkaloids,Lignans,Furofuranoid lignans,0.0,MS1_match,KPZWNZOLVDRTMM-YRDWWIAGSA-N,"InChI=1S/C26H32O12/c1-33-18-8-13(3-5-16(18)28)23-26(32)11-36-22(15(26)10-35-23)12-4-6-17(19(7-12)34-2)37-25-14(9-27)20(29)21(30)24(31)38-25/h3-8,14-15,20-25,27-32H,9-11H2,1-2H3/t14-,15-,20-,21+,22-,23-,24+,25+,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@H]5O[C@H](O)[C@@H](O)[C@H](O)[C@H]5CO)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,KPZWNZOLVDRTMM,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 3290,5144,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton1methanol,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 3291,5138,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.0,MS1_match,PIJWCPNNZULZBH-GRYWMYPUSA-N,"InChI=1S/C18H28O12/c1-7(20)12-8(4-11(21)26-2)9(16(25)27-3)6-28-17(12)30-18-15(24)14(23)13(22)10(5-19)29-18/h6-8,10,12-15,17-20,22-24H,4-5H2,1-3H3/t7-,8+,10+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C[C@@H]1C(C(=O)OC)=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1[C@H](C)O,C18H28O12,pos_1_1proton1ammonium,436.158076336,PIJWCPNNZULZBH,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 3292,5133,-1,,,,0.39467987,ISDB,PIIYQZUBXQHXDG-AETNBWKLSA-N,"InChI=1S/C31H31NO5/c1-32-24-19-27(36-28(33)18-17-21-11-5-2-6-12-21)29(30(34)22-13-7-3-8-14-22)25(32)20-26(24)37-31(35)23-15-9-4-10-16-23/h2-18,24-27,29-30,34H,19-20H2,1H3/b18-17-/t24-,25-,26-,27+,29+,30+/m0/s1",CN1[C@H]2C[C@H](OC(=O)c3ccccc3)[C@@H]1C[C@@H](OC(=O)/C=C\c1ccccc1)[C@@H]2[C@H](O)c1ccccc1,C31H31NO5,,497.220223092,PIIYQZUBXQHXDG,Alkaloids,Ornithine alkaloids,Tropane alkaloids,Eucarpha deplanchei,307793.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Proteales'],['Proteaceae'],['Unknown'],['Eucarpha'],['Eucarpha deplanchei'],4,0,5.57871949672699 3293,5132,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.857499,ISDB,,,,,,,MJLWUDWEHYOWJO,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.4299960136413574 3294,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 3295,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 3296,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 3297,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 3298,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 3299,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 3300,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 3301,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 3302,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 3303,5131,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 3304,5130,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,GJOKUHOJKKOIEW-UHFFFAOYSA-N,"InChI=1S/C12H14O6/c1-7(4-13)12(17)3-11(18-8(2)16)9(5-14)10(12)6-15/h4,6,11,14,17H,1,3,5H2,2H3",C=C(C=O)C1(O)CC(OC(C)=O)C(CO)=C1C=O,C12H14O6,pos_1_1proton2acetonitrile,254.079038168,GJOKUHOJKKOIEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 3305,5128,-1,,,,0.22046678,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.8818671107292175 3306,5128,-1,,,,0.22046678,ISDB,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.8818671107292175 3307,5128,-1,,,,0.22046678,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.8818671107292175 3308,5128,-1,,,,0.22046678,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.8818671107292175 3309,5128,-1,,,,0.22046678,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.8818671107292175 3310,5126,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,DRYLFSKCXKHLKH-XBRJNPSZSA-O,"InChI=1S/C27H33NO13/c1-3-16-17(7-6-14-9-15(24(35)36)11-28(10-14)8-4-5-20(30)31)18(25(37)38-2)13-39-26(16)41-27-23(34)22(33)21(32)19(12-29)40-27/h3,6-7,9-11,13,16-17,19,21-23,26-27,29,32-34H,1,4-5,8,12H2,2H3,(H-,30,31,35,36)/p+1/b7-6+/t16-,17+,19-,21-,22+,23-,26+,27+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)O)c[n+](CCCC(=O)O)c1,C27H34NO13+,pos_1_1proton1isopropanol,580.20246656809,DRYLFSKCXKHLKH,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3311,5125,-1,,,,0.45582578,ISDB,IMODSZKINLUSBQ-QXGRHDLQSA-N,"InChI=1S/C26H30O11/c1-33-18-10-14(5-6-17(18)29)24-16(12-35-26-23(32)22(31)21(30)20(11-28)36-26)15-8-13(4-3-7-27)9-19(34-2)25(15)37-24/h3-10,16,20-24,26,28-32H,11-12H2,1-2H3/b4-3+/t16-,20+,21+,22-,23+,24+,26+/m0/s1",COc1cc([C@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@@H]2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C26H30O11,,518.17881178,IMODSZKINLUSBQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Pluchea indica,446140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pluchea'],['Pluchea indica'],4,0,5.8233031034469604 3312,5125,-1,,,,0.45582578,ISDB,IMODSZKINLUSBQ-AQRJENMISA-N,"InChI=1S/C26H30O11/c1-33-18-10-14(5-6-17(18)29)24-16(12-35-26-23(32)22(31)21(30)20(11-28)36-26)15-8-13(4-3-7-27)9-19(34-2)25(15)37-24/h3-10,16,20-24,26,28-32H,11-12H2,1-2H3/b4-3+/t16-,20-,21-,22+,23-,24+,26-/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C26H30O11,,518.17881178,IMODSZKINLUSBQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Pedicularis torta,36252.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Pedicularideae'],['Pedicularis'],['Pedicularis torta'],4,0,5.8233031034469604 3313,5123,-1,,,,0.0,MS1_match,BVEVSYQMQABMQM-UHFFFAOYSA-N,"InChI=1S/C21H36O11/c1-19(2)9-4-12(20(19,3)5-10(9)23)32-17-15(26)14(25)13(24)11(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-18,22-28H,4-8H2,1-3H3",CC1(C)C2CC(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C1(C)CC2O,C21H36O11,pos_1_sodium,464.225761972,BVEVSYQMQABMQM,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3314,5123,-1,,,,0.0,MS1_match,SFDNWSCFCRWISC-GNMWDIMASA-N,"InChI=1S/C21H36O11/c1-19(2)10-4-5-20(3,32-19)12(6-10)31-17-15(25)14(24)13(23)11(30-17)7-28-18-16(26)21(27,8-22)9-29-18/h10-18,22-27H,4-9H2,1-3H3/t10-,11-,12+,13-,14+,15-,16+,17+,18-,20+,21-/m1/s1",CC1(C)O[C@@]2(C)CC[C@@H]1C[C@@H]2O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H36O11,pos_1_sodium,464.225761972,SFDNWSCFCRWISC,Terpenoids,Monoterpenoids,Monocyclic monoterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,6.0 3315,5122,69,Terpenoids,Sesquiterpenoids,Furans,0.529402,ISDB,CTLVRIOTFRWXKP-BGTYHANMSA-N,"InChI=1S/C18H28O/c1-13-7-6-8-16-17(13,4)11-9-14(2)18(16,5)12-10-15(3)19/h6-7,14,16H,1,8-12H2,2-5H3/t14-,16-,17+,18+/m1/s1",C=C1C=CC[C@H]2[C@@](C)(CCC(C)=O)[C@H](C)CC[C@@]12C,C18H28O,,260.214015516,CTLVRIOTFRWXKP,Terpenoids,Sesquiterpenoids,,Parentucellia latifolia,981066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Rhinantheae'],['Parentucellia'],['Parentucellia latifolia'],4,2,7.117608070373535 3316,5121,-1,,,,0.0,MS1_match,HKMDHBXRMZEVHY-UHFFFAOYSA-N,"InChI=1S/C16H26O8/c1-7-8-3-4-16(2,9(8)6-22-14(7)21)24-15-13(20)12(19)11(18)10(5-17)23-15/h7-13,15,17-20H,3-6H2,1-2H3",CC1C(=O)OCC2C1CCC2(C)OC1OC(CO)C(O)C(O)C1O,C16H26O8,pos_1_1proton1ammonium,346.1627677919999,HKMDHBXRMZEVHY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 3317,5121,-1,,,,0.0,MS1_match,PLSSBWGEYMENGJ-XLIFQNPRSA-N,"InChI=1S/C16H26O8/c1-7-2-3-9-8(5-22-15(21)11(7)9)6-23-16-14(20)13(19)12(18)10(4-17)24-16/h7-14,16-20H,2-6H2,1H3/t7-,8+,9+,10+,11+,12+,13+,14-,16+/m0/s1",C[C@H]1CC[C@@H]2[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)COC(=O)[C@@H]21,C16H26O8,pos_1_1proton1ammonium,346.162767792,PLSSBWGEYMENGJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 3318,5118,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton1methanol,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 3319,5115,-1,,,,0.0,MS1_match,RPMNUQRUHXIGHK-UHFFFAOYSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O14,pos_2MH,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 3320,5115,-1,,,,0.0,MS1_match,RPMNUQRUHXIGHK-PYXJVEIZSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_2MH,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3321,5112,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.70603603,ISDB,HEURLRKWAYKLCX-DEOSSOPVSA-N,"InChI=1S/C30H20O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-11,24,31-36H,12H2/t24-/m0/s1",O=C1C[C@@H](c2ccc(O)cc2)Oc2c1c(O)cc(O)c2-c1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O,C30H20O10,,540.10564684,HEURLRKWAYKLCX,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Viburnum jucundum,572534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum jucundum'],5,3,9.324144124984741 3322,5111,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.70603603,ISDB,HEURLRKWAYKLCX-DEOSSOPVSA-N,"InChI=1S/C30H20O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-11,24,31-36H,12H2/t24-/m0/s1",O=C1C[C@@H](c2ccc(O)cc2)Oc2c1c(O)cc(O)c2-c1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O,C30H20O10,,540.10564684,HEURLRKWAYKLCX,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Viburnum jucundum,572534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum jucundum'],5,3,9.324144124984741 3323,5110,1005,,,,0.3348036,ISDB,,,,,,,UWIXNZGLUYYNRV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3392144441604614 3324,5109,-1,,,,0.4773462,ISDB,XUACNUJFOIKYPQ-UHFFFAOYSA-N,"InChI=1S/C16H19NO7/c18-10(5-7-6-17-9-4-2-1-3-8(7)9)24-16-14(22)12(20)11(19)13(21)15(16)23/h1-4,6,11-17,19-23H,5H2",O=C(Cc1c[nH]c2ccccc12)OC1C(O)C(O)C(O)C(O)C1O,C16H19NO7,,337.116151948,XUACNUJFOIKYPQ,,,,Zea mays,605194.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Andropogoneae'],['Zea'],['Zea mays'],4,0,5.909384846687317 3325,5109,-1,,,,0.4773462,ISDB,XUACNUJFOIKYPQ-JQOWZUPLSA-N,"InChI=1S/C16H19NO7/c18-10(5-7-6-17-9-4-2-1-3-8(7)9)24-16-14(22)12(20)11(19)13(21)15(16)23/h1-4,6,11-17,19-23H,5H2/t11-,12-,13-,14-,15+,16+/m1/s1",O=C(Cc1c[nH]c2ccccc12)O[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)[C@@H]1O,C16H19NO7,,337.116151948,XUACNUJFOIKYPQ,,,,Oryza sativa,709894.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Oryzeae'],['Oryza'],['Oryza sativa'],4,0,5.909384846687317 3326,5107,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 3327,5107,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHNH3,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 3328,5106,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7178107,ISDB,ORHBXUUXSCNDEV-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H",O=c1ccc2ccc(O)cc2o1,C9H6O3,,162.031694052,ORHBXUUXSCNDEV,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Viburnum cylindricum,205162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum cylindricum'],5,3,9.371242761611938 3329,5106,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7178107,ISDB,ORHBXUUXSCNDEV-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H",O=c1ccc2ccc(O)cc2o1,C9H6O3,,162.031694052,ORHBXUUXSCNDEV,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Viburnum dilatatum,205155.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum dilatatum'],5,3,9.371242761611938 3330,5105,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.42996392,ISDB,,,,,,,KIYCIOLOFSAKHH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.7198556661605835 3331,5102,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BVEVSYQMQABMQM-UHFFFAOYSA-N,"InChI=1S/C21H36O11/c1-19(2)9-4-12(20(19,3)5-10(9)23)32-17-15(26)14(25)13(24)11(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-18,22-28H,4-8H2,1-3H3",CC1(C)C2CC(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C1(C)CC2O,C21H36O11,pos_1_1proton1ammonium,464.225761972,BVEVSYQMQABMQM,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 3332,5100,-1,,,,0.0,MS1_match,SCTDPJFVWAWKPB-JBKQMOEBSA-N,"InChI=1S/C24H28O10/c25-8-17-19(26)20(27)21(28)24(33-17)34-23-18-13(15(10-32-23)22(29)30)6-12-7-16(18)31-9-14(12)11-4-2-1-3-5-11/h1-5,9-10,12-13,16-21,23-28H,6-8H2,(H,29,30)/t12-,13-,16-,17-,18+,19-,20+,21-,23+,24+/m1/s1",O=C(O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C[C@@H]1C[C@H]2OC=C1c1ccccc1,C24H28O10,pos_2_2proton2acetonitrile,476.1682470959998,SCTDPJFVWAWKPB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3333,5098,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.51898366,ISDB,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,9.575934648513794 3334,5098,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.51898366,ISDB,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,9.575934648513794 3335,5097,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,ZEIIWKCRPSSDKR-UHFFFAOYSA-N,"InChI=1S/C27H35NO13/c1-3-16-17(7-6-14-9-15(24(35)36)11-28(10-14)8-4-5-20(30)31)18(25(37)38-2)13-39-26(16)41-27-23(34)22(33)21(32)19(12-29)40-27/h3,6-7,9,11,13,16-17,19,21-23,26-27,29,32-34H,1,4-5,8,10,12H2,2H3,(H,30,31)(H,35,36)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=CN(CCCC(=O)O)C1,C27H35NO13,pos_1_1proton1methanol,581.21084018,ZEIIWKCRPSSDKR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 3336,5096,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.36337978,ISDB,NWYPSJATNKDRKG-UHFFFAOYSA-N,"InChI=1S/C12H16O6/c1-16-9-4-7(5-10(17-2)12(9)15)8(13)6-11(14)18-3/h4-5,8,13,15H,6H2,1-3H3",COC(=O)CC(O)c1cc(OC)c(O)c(OC)c1,C12H16O6,,256.094688232,NWYPSJATNKDRKG,,,,Ruta graveolens,596623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Ruta'],['Ruta graveolens'],4,0,5.453519105911255 3337,5095,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.41419813,ISDB,JTRQVQVHKAAXON-VIFPVBQESA-N,"InChI=1S/C13H17NO4/c1-4-9(12(15)17-2)8-11-10(13(16)18-3)6-5-7-14-11/h5-7,9H,4,8H2,1-3H3/t9-/m0/s1",CC[C@@H](Cc1ncccc1C(=O)OC)C(=O)OC,C13H17NO4,,251.115758024,JTRQVQVHKAAXON,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],4,1,6.156792521476746 3338,5094,143,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,WZDQZUZGMJUYFF-ZZQRAECTSA-N,"InChI=1S/C25H34O8/c1-14(2)7-20(26)29-11-17-12-30-24(33-22(28)9-16(5)6)23-18(17)10-19(25(23)13-31-25)32-21(27)8-15(3)4/h9-10,12,14-15,19,23-24H,7-8,11,13H2,1-6H3/t19-,23+,24-,25+/m0/s1",CC(C)=CC(=O)O[C@@H]1OC=C(COC(=O)CC(C)C)C2=C[C@H](OC(=O)CC(C)C)[C@]3(CO3)[C@H]21,C25H34O8,pos_2_2sodium,462.2253680479999,WZDQZUZGMJUYFF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 3339,5091,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.23579952,ISDB,PGYAYSRVSAJXTE-CLONMANBSA-N,"InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35-36(5,6)25-33(41)27-38(35,9)43)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-21,23-24,33-34,41-43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t22?,33-,34-,38+,39+,40-/m0/s1",C/C(C=C=C1C(C)(C)C[C@H](O)C[C@@]1(C)O)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C,C40H56O4,,600.417860272,PGYAYSRVSAJXTE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Trollius europaeus,805006.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius europaeus'],6,3,8.443198084831238 3340,5090,-1,,,,0.35450858,ISDB,CNPNWGHRMBQHBZ-ZKWXMUAHSA-N,"InChI=1S/C11H21N3O4/c1-3-6(2)9(13)10(16)14-7(11(17)18)4-5-8(12)15/h6-7,9H,3-5,13H2,1-2H3,(H2,12,15)(H,14,16)(H,17,18)/t6-,7-,9-/m0/s1",CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)O,C11H21N3O4,,259.153206152,CNPNWGHRMBQHBZ,Amino acids and Peptides,Small peptides,Dipeptides,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,0,5.418034315109253 3341,5089,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.42271852,ISDB,WBWMANUPDBBHGO-YYWYGQEZSA-N,"InChI=1S/C18H37NO5/c20-12-8-10-14(22)9-6-4-2-1-3-5-7-11-15-17(23)18(24)16(13-21)19-15/h14-24H,1-13H2/t14-,15+,16+,17+,18+/m0/s1",OCCC[C@@H](O)CCCCCCCCC[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O,C18H37NO5,,347.267173284,WBWMANUPDBBHGO,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Broussonetia kazinoki,734176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Broussonetia'],['Broussonetia kazinoki'],4,0,5.690874099731445 3342,5089,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.42271852,ISDB,WBWMANUPDBBHGO-UHFFFAOYSA-N,"InChI=1S/C18H37NO5/c20-12-8-10-14(22)9-6-4-2-1-3-5-7-11-15-17(23)18(24)16(13-21)19-15/h14-24H,1-13H2",OCCCC(O)CCCCCCCCCC1NC(CO)C(O)C1O,C18H37NO5,,347.267173284,WBWMANUPDBBHGO,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Broussonetia papyrifera,311274.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Broussonetia'],['Broussonetia papyrifera'],4,0,5.690874099731445 3343,5088,-1,,,,0.0,MS1_match,GREGWBBWKKBCEU-PWXALIIZSA-N,"InChI=1S/C35H38N2O6/c1-37-30(27-10-9-26(41-2)17-24(27)19-35(37)40)15-22-6-11-31(38)34(16-22)43-25-7-4-21(5-8-25)14-29-28-20-32(39)33(42-3)18-23(28)12-13-36-29/h4-11,16-18,20,29-30,35-36,38-40H,12-15,19H2,1-3H3/t29?,30-,35-/m0/s1",COc1ccc2c(c1)C[C@H](O)N(C)[C@H]2Cc1ccc(O)c(Oc2ccc(CC3NCCc4cc(OC)c(O)cc43)cc2)c1,C35H38N2O6,pos_2_2proton2acetonitrile,582.272986936,GREGWBBWKKBCEU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 3344,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-UHFFFAOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3",CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1C,C48H78O20,pos_3_2proton1sodium,974.5086448960004,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 3345,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-UHFFFAOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3",CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1C,C48H78O20,pos_3_2proton1sodium,974.5086448960004,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 3346,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-UHFFFAOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3",CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1C,C48H78O20,pos_3_2proton1sodium,974.5086448960004,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 3347,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-HCZMHFOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3/t19-,20+,21+,23-,24-,25-,26-,27-,28+,29+,30-,31-,32+,33-,34-,35-,36-,37-,38-,39+,40-,41+,42+,44-,45+,46-,47-,48+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@]43C)[C@H]12,C48H78O20,pos_3_2proton1sodium,974.508644896,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea asiatica,462241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea asiatica'],6,0,6.0 3348,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-UHFFFAOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3",CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1C,C48H78O20,pos_3_2proton1sodium,974.5086448960004,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 3349,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-UHFFFAOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3",CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1C,C48H78O20,pos_3_2proton1sodium,974.5086448960004,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 3350,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-UHFFFAOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3",CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1C,C48H78O20,pos_3_2proton1sodium,974.5086448960004,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 3351,5088,-1,,,,0.0,MS1_match,BNMGUJRJUUDLHW-HCZMHFOYSA-N,"InChI=1S/C48H78O20/c1-19-10-11-48(13-12-46(6)22(28(48)20(19)2)8-9-27-44(4)14-24(52)39(61)45(5,18-50)38(44)23(51)15-47(27,46)7)43(62)68-42-35(59)32(56)30(54)26(66-42)17-63-40-36(60)33(57)37(25(16-49)65-40)67-41-34(58)31(55)29(53)21(3)64-41/h8,19-21,23-42,49-61H,9-18H2,1-7H3/t19-,20+,21+,23-,24-,25-,26-,27-,28+,29+,30-,31-,32+,33-,34-,35-,36-,37-,38-,39+,40-,41+,42+,44-,45+,46-,47-,48+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@]43C)[C@H]12,C48H78O20,pos_3_2proton1sodium,974.508644896,BNMGUJRJUUDLHW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Actaea asiatica,462241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea asiatica'],6,0,6.0 3352,5088,-1,,,,0.0,MS1_match,NNWMHSNRRWMMBI-PJISEHJASA-N,"InChI=1S/C48H78O20/c1-20-28(53)30(55)33(58)40(64-20)67-36-25(17-49)65-39(35(60)32(36)57)63-18-26-29(54)31(56)34(59)41(66-26)68-42(62)48-12-10-43(2,3)14-22(48)21-8-9-27-44(4)15-24(52)38(61)45(5,19-50)37(44)23(51)16-47(27,7)46(21,6)11-13-48/h8,20,22-41,49-61H,9-19H2,1-7H3/t20-,22-,23+,24+,25+,26+,27+,28-,29+,30+,31-,32+,33+,34+,35+,36+,37+,38-,39+,40-,41-,44+,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]7[C@H](O)C[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O20,pos_3_2proton1sodium,974.508644896,NNWMHSNRRWMMBI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Actaea asiatica,462241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea asiatica'],6,0,6.0 3353,5088,-1,,,,0.0,MS1_match,NNWMHSNRRWMMBI-PJISEHJASA-N,"InChI=1S/C48H78O20/c1-20-28(53)30(55)33(58)40(64-20)67-36-25(17-49)65-39(35(60)32(36)57)63-18-26-29(54)31(56)34(59)41(66-26)68-42(62)48-12-10-43(2,3)14-22(48)21-8-9-27-44(4)15-24(52)38(61)45(5,19-50)37(44)23(51)16-47(27,7)46(21,6)11-13-48/h8,20,22-41,49-61H,9-19H2,1-7H3/t20-,22-,23+,24+,25+,26+,27+,28-,29+,30+,31-,32+,33+,34+,35+,36+,37+,38-,39+,40-,41-,44+,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]7[C@H](O)C[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O20,pos_3_2proton1sodium,974.508644896,NNWMHSNRRWMMBI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Actaea asiatica,462241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea asiatica'],6,0,6.0 3354,5086,-1,,,,0.0,MS1_match,WKHHFWJJIRCXHA-INIZCTEOSA-N,"InChI=1S/C22H28NO4/c1-23(2)8-7-13-10-19(26-5)22(27-6)21-15-12-18(25-4)17(24-3)11-14(15)9-16(23)20(13)21/h10-12,16H,7-9H2,1-6H3/q+1/t16-/m0/s1",COc1cc2c(cc1OC)-c1c(OC)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C22H28NO4+,pos_2MHNH3,370.20128479609,WKHHFWJJIRCXHA,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Isopyrum thalictroides,949657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Isopyrum'],['Isopyrum thalictroides'],6,0,6.0 3355,5086,-1,,,,0.0,MS1_match,WKHHFWJJIRCXHA-INIZCTEOSA-N,"InChI=1S/C22H28NO4/c1-23(2)8-7-13-10-19(26-5)22(27-6)21-15-12-18(25-4)17(24-3)11-14(15)9-16(23)20(13)21/h10-12,16H,7-9H2,1-6H3/q+1/t16-/m0/s1",COc1cc2c(cc1OC)-c1c(OC)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C22H28NO4+,pos_2MHNH3,370.20128479609,WKHHFWJJIRCXHA,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Isopyrum thalictroides,949657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Isopyrum'],['Isopyrum thalictroides'],6,0,6.0 3356,5085,-1,,,,0.0,MS1_match,YJMNEZANCYQLJR-RXRZWOQSSA-N,"InChI=1S/C30H26O13/c31-12-6-17(35)23-22(7-12)42-29(10-1-2-14(32)16(34)3-10)27(41)25(23)24-18(36)9-15(33)13-8-21(39)28(43-30(13)24)11-4-19(37)26(40)20(38)5-11/h1-7,9,21,25,27-29,31-41H,8H2/t21-,25?,27-,28-,29-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2c1c(O)cc(O)c2c1O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C30H26O13,pos_1_sodium,594.137340892,YJMNEZANCYQLJR,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,0,6.0 3357,5085,-1,,,,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1potassium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 3358,5085,-1,,,,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1potassium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,6.0 3359,5085,-1,,,,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1potassium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 3360,5085,-1,,,,0.0,MS1_match,PUPKKEQDLNREIM-QNSQPKOQSA-N,"InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1potassium,578.1635556399999,PUPKKEQDLNREIM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,6.0 3361,5085,-1,,,,0.0,MS1_match,UREPCGRALLQPJF-CTVCQPQISA-N,"InChI=1S/C27H30O14/c1-9(28)22-18(33)20(35)26(39-22)37-13-7-14(31)16-15(8-13)38-24(11-3-5-12(30)6-4-11)25(17(16)32)41-27-21(36)19(34)23(40-27)10(2)29/h3-10,18-23,26-31,33-36H,1-2H3/t9-,10-,18-,19+,20+,21-,22+,23-,26+,27+/m0/s1",C[C@H](O)[C@@H]1O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@H]([C@H](C)O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)[C@@H](O)[C@H]1O,C27H30O14,pos_1_1potassium,578.1635556399999,UREPCGRALLQPJF,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 3362,5085,-1,,,,0.0,MS1_match,UREPCGRALLQPJF-CTVCQPQISA-N,"InChI=1S/C27H30O14/c1-9(28)22-18(33)20(35)26(39-22)37-13-7-14(31)16-15(8-13)38-24(11-3-5-12(30)6-4-11)25(17(16)32)41-27-21(36)19(34)23(40-27)10(2)29/h3-10,18-23,26-31,33-36H,1-2H3/t9-,10-,18-,19+,20+,21-,22+,23-,26+,27+/m0/s1",C[C@H](O)[C@@H]1O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4O[C@H]([C@H](C)O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)[C@@H](O)[C@H]1O,C27H30O14,pos_1_1potassium,578.1635556399999,UREPCGRALLQPJF,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 3363,5084,-1,,,,0.2142799,ISDB,FCVLIMJMXLPMSE-UHFFFAOYSA-N,"InChI=1S/C13H11NO5/c1-6-11(16)8-3-4-14-9(5-19-7(2)15)10(8)13(18)12(6)17/h3-4,17H,5H2,1-2H3",CC(=O)OCc1nccc2c1C(=O)C(O)=C(C)C2=O,C13H11NO5,,261.06372245200004,FCVLIMJMXLPMSE,Polyketides,Naphthalenes,Naphthoquinones,Neopetrosia similis,4939026.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Haplosclerida'],['Petrosiidae'],['Unknown'],['Neopetrosia'],['Neopetrosia similis'],1,0,1.857119619846344 3364,5077,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.25792766,ISDB,YCEDLUKLAQSNAA-NVZATTGYSA-N,"InChI=1S/C24H38O8/c1-15-8-9-18-23(2,14-25)10-7-11-24(18,3)17(15)13-32-20(22(28)31-6)16(21(27)30-5)12-19(26)29-4/h16-18,20,25H,1,7-14H2,2-6H3/t16-,17-,18-,20+,23-,24+/m0/s1",C=C1CC[C@H]2[C@](C)(CO)CCC[C@]2(C)[C@H]1CO[C@@H](C(=O)OC)[C@H](CC(=O)OC)C(=O)OC,C24H38O8,,454.256668176,YCEDLUKLAQSNAA,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,Cryptoporus sinensis,3800745.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Polyporales'],['Polyporaceae'],['Unknown'],['Cryptoporus'],['Cryptoporus sinensis'],1,1,2.531710624694824 3365,5075,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.6387678,ISDB,USMNOWBWPHYOEA-MRTMQBJTSA-N,"InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1",CC(C)[C@]12CC(=O)[C@H](C)[C@H]1C2,C10H16O,,152.120115132,USMNOWBWPHYOEA,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,2,9.555071115493774 3366,5074,-1,,,,0.34471238,ISDB,OZTNIMLSGDADPT-LNLDCUPPSA-N,"InChI=1S/C34H38O9/c1-20-12-11-17-23-31(20,2)27(42-29(38)22-15-9-6-10-16-22)25(35)33(4)32(23,3)24(41-28(37)21-13-7-5-8-14-21)18-34(43-33)19-40-30(39)26(34)36/h5-10,12-16,23-27,35-36H,11,17-19H2,1-4H3/t23-,24-,25-,26-,27-,31-,32-,33-,34-/m0/s1",CC1=CCC[C@H]2[C@@]1(C)[C@@H](OC(=O)c1ccccc1)[C@H](O)[C@]1(C)O[C@]3(COC(=O)[C@@H]3O)C[C@H](OC(=O)c3ccccc3)[C@]21C,C34H38O9,,590.251582796,OZTNIMLSGDADPT,Terpenoids,,,Scutellaria barbata,1093028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Scutellaria'],['Scutellaria barbata'],4,0,5.378849506378174 3367,5072,614,Fatty acids,Glycerophospholipids,Glycerophosphates,0.7971584,ISDB,DVNZKWQUAXJYGB-UHFFFAOYSA-N,"InChI=1S/C21H37O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h3-4,6-7,9-10,20,22H,2,5,8,11-19H2,1H3,(H2,24,25,26)",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)(O)O,C21H37O7P,,432.2276901539999,DVNZKWQUAXJYGB,Fatty acids,Glycerophospholipids,Glycerophosphates,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.688633680343628 3368,5070,1027,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-γ)",0.30418837,ISDB,UIUSQYGQZRBKCC-NHWXEJKLSA-N,"InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-26,36-37,41H,5,27-29H2,1-4,6-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+/t36-,37+/m1/s1",C=C1C=CCC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C,C40H54O,,550.417466348,UIUSQYGQZRBKCC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-γ)",Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,3,6.7167534828186035 3369,5068,731,Alkaloids,Lignans,Furofuranoid lignans,0.2310984,ISDB,FQIADTNEIOLURP-GRLWGSQLSA-N,"InChI=1S/C14H19NO5/c1-18-10-3-5-15-11(6-10)14-7-9(16)2-4-13(14,20-15)8-12(17)19-14/h2,4,9-11,16H,3,5-8H2,1H3/t9-,10-,11-,13-,14-/m0/s1",CO[C@H]1CCN2O[C@]34C=C[C@H](O)C[C@]3(OC(=O)C4)[C@@H]2C1,C14H19NO5,,281.12632270800003,FQIADTNEIOLURP,Alkaloids,,,Flueggea suffruticosa,351504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Flueggea'],['Flueggea suffruticosa'],4,1,5.424393594264984 3370,5067,-1,,,,0.66538984,ISDB,XDTYFVALIAILOT-UHFFFAOYSA-N,"InChI=1S/C10H13NO3/c1-6-8(7(2)12)4-11-5-9(6)10(13)14-3/h4-5,7,12H,1-3H3",COC(=O)c1cncc(C(C)O)c1C,C10H13NO3,,195.089543276,XDTYFVALIAILOT,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Strychnos spinosa,164458.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Loganiaceae'],['Unknown'],['Strychnos'],['Strychnos spinosa'],4,0,6.661559343338013 3371,5067,-1,,,,0.66538984,ISDB,XDTYFVALIAILOT-UHFFFAOYSA-N,"InChI=1S/C10H13NO3/c1-6-8(7(2)12)4-11-5-9(6)10(13)14-3/h4-5,7,12H,1-3H3",COC(=O)c1cncc(C(C)O)c1C,C10H13NO3,,195.089543276,XDTYFVALIAILOT,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Strychnos cocculoides,426475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Loganiaceae'],['Unknown'],['Strychnos'],['Strychnos cocculoides'],4,0,6.661559343338013 3372,5066,809,Terpenoids,Steroids,Cholestane steroids,0.49433786,ISDB,NAPNLPVMHUZNFG-BHTYWNIDSA-N,"InChI=1S/C28H48O4/c1-16(2)17(3)7-12-28(6,32)25-23(31)15-21-24-20(9-11-27(21,25)5)26(4)10-8-19(29)13-18(26)14-22(24)30/h14,16-17,19-25,29-32H,7-13,15H2,1-6H3/t17-,19+,20+,21+,22-,23+,24-,25+,26+,27+,28+/m1/s1",CC(C)[C@H](C)CC[C@](C)(O)[C@H]1[C@@H](O)C[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C,C28H48O4,,448.35526001599993,NAPNLPVMHUZNFG,Terpenoids,Steroids,Cholestane steroids,Melia azedarach,916052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Melia'],['Melia azedarach'],4,3,7.477351427078247 3373,5065,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,pos_1_1proton1methanol,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,2,7.0 3374,5065,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,pos_1_1proton1methanol,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,2,7.0 3375,5064,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.40858144,ISDB,SPYAOTULQPJFGN-XUKBFMRMSA-N,"InChI=1S/C21H36O9/c1-9-5-11(28-18-17(26)16(25)15(24)12(8-22)29-18)14-10(9)6-21(27)13(23)7-20(14,4)30-19(21,2)3/h9-18,22-27H,5-8H2,1-4H3/t9-,10-,11-,12-,13+,14-,15-,16+,17-,18-,20-,21+/m1/s1",C[C@@H]1C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C[C@]1(O)[C@@H](O)C[C@@]2(C)OC1(C)C,C21H36O9,,432.235932732,SPYAOTULQPJFGN,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Daucus carota,372836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Daucus'],['Daucus carota'],4,3,7.134325742721558 3376,5063,422,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.3586111,ISDB,YCBFPRSZKYUJNI-DPZMMSJYSA-N,"InChI=1S/C21H36O8/c1-10(2)11-7-14-20(3,8-12(11)23)6-5-15(21(14,4)27)29-19-18(26)17(25)16(24)13(9-22)28-19/h11-19,22-27H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15-,16+,17-,18+,19-,20+,21-/m0/s1",C=C(C)[C@@H]1C[C@@H]2[C@](C)(CC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@]2(C)O)C[C@H]1O,C21H36O8,,416.241018112,YCBFPRSZKYUJNI,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Tessaria integrifolia,705691.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Tessaria'],['Tessaria integrifolia'],4,3,6.934444427490234 3377,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,IBGBGRVKPALMCQ-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-4-5-1-2-6(9)7(10)3-5/h1-4,9-10H",O=Cc1ccc(O)c(O)c1,C7H6O3,pos_1_1proton1methanol,138.031694052,IBGBGRVKPALMCQ,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,1,6.5 3378,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,1,6.5 3379,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,1,6.5 3380,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,1,6.5 3381,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,1,6.5 3382,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,1,6.5 3383,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,1,6.5 3384,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,1,6.5 3385,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,YGSDEFSMJLZEOE-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccccc1O,C7H6O3,pos_1_1proton1methanol,138.031694052,YGSDEFSMJLZEOE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,1,6.5 3386,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Delphinium venulosum,885408.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium venulosum'],6,1,6.5 3387,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,IBGBGRVKPALMCQ-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-4-5-1-2-6(9)7(10)3-5/h1-4,9-10H",O=Cc1ccc(O)c(O)c1,C7H6O3,pos_1_1proton1methanol,138.031694052,IBGBGRVKPALMCQ,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,Ranunculus sceleratus,747491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sceleratus'],6,1,6.5 3388,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Delphinium giraldii,6131653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium giraldii'],6,1,6.5 3389,5062,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,YGSDEFSMJLZEOE-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccccc1O,C7H6O3,pos_1_1proton1methanol,138.031694052,YGSDEFSMJLZEOE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,1,6.5 3390,5061,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.47020888,ISDB,SESLBPIXVOYQJJ-UHFFFAOYSA-N,"InChI=1S/C28H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32-28(30)22-20-25-19-21-26(29)27(24-25)31-2/h19-22,24,29H,3-18,23H2,1-2H3",CCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(OC)c1,C28H46O4,,446.33960995199993,SESLBPIXVOYQJJ,Shikimates and Phenylpropanoids,,,Dorstenia psilurus,564311.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Dorstenia'],['Dorstenia psilurus'],4,0,5.88083553314209 3391,5061,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.47020888,ISDB,SESLBPIXVOYQJJ-XDOYNYLZSA-N,"InChI=1S/C28H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32-28(30)22-20-25-19-21-26(29)27(24-25)31-2/h19-22,24,29H,3-18,23H2,1-2H3/b22-20-",CCCCCCCCCCCCCCCCCCOC(=O)/C=C\c1ccc(O)c(OC)c1,C28H46O4,,446.339609952,SESLBPIXVOYQJJ,Shikimates and Phenylpropanoids,,,Pavetta owariensis,7626926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Pavetteae'],['Pavetta'],['Pavetta owariensis'],4,0,5.88083553314209 3392,5061,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.47020888,ISDB,SESLBPIXVOYQJJ-UHFFFAOYSA-N,"InChI=1S/C28H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32-28(30)22-20-25-19-21-26(29)27(24-25)31-2/h19-22,24,29H,3-18,23H2,1-2H3",CCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(OC)c1,C28H46O4,,446.33960995199993,SESLBPIXVOYQJJ,Shikimates and Phenylpropanoids,,,Fibraurea tinctoria,678311.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Burasaieae'],['Fibraurea'],['Fibraurea tinctoria'],4,0,5.88083553314209 3393,5061,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.47020888,ISDB,SESLBPIXVOYQJJ-UHFFFAOYSA-N,"InChI=1S/C28H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32-28(30)22-20-25-19-21-26(29)27(24-25)31-2/h19-22,24,29H,3-18,23H2,1-2H3",CCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(OC)c1,C28H46O4,,446.33960995199993,SESLBPIXVOYQJJ,Shikimates and Phenylpropanoids,,,Rubia tinctorum,782821.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Rubia'],['Rubia tinctorum'],4,0,5.88083553314209 3394,5061,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.47020888,ISDB,SESLBPIXVOYQJJ-UHFFFAOYSA-N,"InChI=1S/C28H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32-28(30)22-20-25-19-21-26(29)27(24-25)31-2/h19-22,24,29H,3-18,23H2,1-2H3",CCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(OC)c1,C28H46O4,,446.33960995199993,SESLBPIXVOYQJJ,Shikimates and Phenylpropanoids,,,Euchresta formosana,280933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Euchresta'],['Euchresta formosana'],4,0,5.88083553314209 3395,5060,532,Terpenoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,ZHVQMCUOORXZKC-UHFFFAOYSA-N,"InChI=1S/C12H10O6/c1-16-11-9(14)7(12(15)17-2)5-6-3-4-8(13)18-10(6)11/h3-5,14H,1-2H3",COC(=O)c1cc2ccc(=O)oc2c(OC)c1O,C12H10O6,pos_1_1proton1ammonium,250.04773804,ZHVQMCUOORXZKC,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Delphinium stenocarpum,784182.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella stenocarpa'],6,3,7.5 3396,5059,-1,,,,0.0,MS1_match,NZOONSXGDPBWBZ-HZMJLDKASA-N,"InChI=1S/C25H40O11/c1-12-9-14(26)10-24(3,4)25(12,33)8-7-13(2)35-23-22(32)21(31)20(30)17(36-23)11-34-16-6-5-15(27)18(28)19(16)29/h7-9,13,15-23,27-33H,5-6,10-11H2,1-4H3/b8-7+/t13-,15+,16-,17-,18+,19+,20-,21+,22-,23-,25-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2CC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O11,pos_1_sodium,516.2570621,NZOONSXGDPBWBZ,Terpenoids,Apocarotenoids,Megastigmanes,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 3397,5058,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,VDKFCMZNYZMXRF-QYOTWRPRSA-N,"InChI=1S/C30H38O7/c1-26-7-9-29(4)20-12-18(32)23-16(15-31)24(35)19(33)11-17(23)27(20,2)8-10-30(29,5)21(26)13-28(3,22(34)14-26)25(36)37-6/h11,15,20-21,33,35H,7-10,12-14H2,1-6H3/t20?,21-,26+,27+,28+,29-,30+/m1/s1",COC(=O)[C@@]1(C)C[C@@H]2[C@@](C)(CC[C@]3(C)C4CC(=O)c5c(cc(O)c(O)c5C=O)[C@]4(C)CC[C@@]23C)CC1=O,C30H38O7,pos_2_2sodium,510.2617535559999,VDKFCMZNYZMXRF,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,1,6.5 3398,5058,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,VDKFCMZNYZMXRF-QYOTWRPRSA-N,"InChI=1S/C30H38O7/c1-26-7-9-29(4)20-12-18(32)23-16(15-31)24(35)19(33)11-17(23)27(20,2)8-10-30(29,5)21(26)13-28(3,22(34)14-26)25(36)37-6/h11,15,20-21,33,35H,7-10,12-14H2,1-6H3/t20?,21-,26+,27+,28+,29-,30+/m1/s1",COC(=O)[C@@]1(C)C[C@@H]2[C@@](C)(CC[C@]3(C)C4CC(=O)c5c(cc(O)c(O)c5C=O)[C@]4(C)CC[C@@]23C)CC1=O,C30H38O7,pos_2_2sodium,510.2617535559999,VDKFCMZNYZMXRF,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,1,6.5 3399,5058,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,DXDSZUXZQIKMRQ-GMZGOHOASA-N,"InChI=1S/C30H38O7/c1-26-7-8-27(2,25(36)37-6)15-20(26)30(5)12-10-28(3)16-13-18(32)23(33)22(24(34)35)21(16)17(31)14-19(28)29(30,4)11-9-26/h13-14,20,32-33H,7-12,15H2,1-6H3,(H,34,35)/t20-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC(=O)c5c(cc(O)c(O)c5C(=O)O)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H38O7,pos_2_2sodium,510.2617535559998,DXDSZUXZQIKMRQ,Terpenoids,,,Kokoona zeylanica,6092887.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Kokoona'],['Kokoona zeylanica'],6,1,6.5 3400,5058,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,DXDSZUXZQIKMRQ-GMZGOHOASA-N,"InChI=1S/C30H38O7/c1-26-7-8-27(2,25(36)37-6)15-20(26)30(5)12-10-28(3)16-13-18(32)23(33)22(24(34)35)21(16)17(31)14-19(28)29(30,4)11-9-26/h13-14,20,32-33H,7-12,15H2,1-6H3,(H,34,35)/t20-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC(=O)c5c(cc(O)c(O)c5C(=O)O)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H38O7,pos_2_2sodium,510.2617535559998,DXDSZUXZQIKMRQ,Terpenoids,,,Kokoona reflexa,5750149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Kokoona'],['Kokoona reflexa'],6,1,6.5 3401,5058,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,DXDSZUXZQIKMRQ-GMZGOHOASA-N,"InChI=1S/C30H38O7/c1-26-7-8-27(2,25(36)37-6)15-20(26)30(5)12-10-28(3)16-13-18(32)23(33)22(24(34)35)21(16)17(31)14-19(28)29(30,4)11-9-26/h13-14,20,32-33H,7-12,15H2,1-6H3,(H,34,35)/t20-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC(=O)c5c(cc(O)c(O)c5C(=O)O)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H38O7,pos_2_2sodium,510.2617535559998,DXDSZUXZQIKMRQ,Terpenoids,,,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,1,6.5 3402,5058,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,DXDSZUXZQIKMRQ-GMZGOHOASA-N,"InChI=1S/C30H38O7/c1-26-7-8-27(2,25(36)37-6)15-20(26)30(5)12-10-28(3)16-13-18(32)23(33)22(24(34)35)21(16)17(31)14-19(28)29(30,4)11-9-26/h13-14,20,32-33H,7-12,15H2,1-6H3,(H,34,35)/t20-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC(=O)c5c(cc(O)c(O)c5C(=O)O)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H38O7,pos_2_2sodium,510.2617535559998,DXDSZUXZQIKMRQ,Terpenoids,,,Maytenus woodsonii,433240.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus woodsonii'],6,1,6.5 3403,5057,-1,,,,0.43595326,ISDB,VNZPJUCTIYWVGR-UHFFFAOYSA-N,"InChI=1S/C25H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20-23(26)21-24(27-2)25(22)28-3/h20-21,26H,4-19H2,1-3H3",CCCCCCCCCCCCCCCCCc1cc(O)cc(OC)c1OC,C25H44O3,,392.329045268,VNZPJUCTIYWVGR,Polyketides,Aromatic polyketides,Catechols with side chains,Iris missouriensis,74513.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Iridaceae'],['Irideae'],['Iris'],['Iris missouriensis'],4,0,5.7438130378723145 3404,5057,-1,,,,0.43595326,ISDB,VNZPJUCTIYWVGR-UHFFFAOYSA-N,"InChI=1S/C25H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20-23(26)21-24(27-2)25(22)28-3/h20-21,26H,4-19H2,1-3H3",CCCCCCCCCCCCCCCCCc1cc(O)cc(OC)c1OC,C25H44O3,,392.329045268,VNZPJUCTIYWVGR,Polyketides,Aromatic polyketides,Catechols with side chains,Iris sibirica,43087.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Iridaceae'],['Irideae'],['Iris'],['Iris sibirica'],4,0,5.7438130378723145 3405,5057,-1,,,,0.43595326,ISDB,VNZPJUCTIYWVGR-UHFFFAOYSA-N,"InChI=1S/C25H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20-23(26)21-24(27-2)25(22)28-3/h20-21,26H,4-19H2,1-3H3",CCCCCCCCCCCCCCCCCc1cc(O)cc(OC)c1OC,C25H44O3,,392.329045268,VNZPJUCTIYWVGR,Polyketides,Aromatic polyketides,Catechols with side chains,Iris pseudacorus,43059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Iridaceae'],['Irideae'],['Iris'],['Iris pseudacorus'],4,0,5.7438130378723145 3406,5052,-1,,,,0.0,MS1_match,YEUIANWBIIZWTM-KORLLVGLSA-N,"InChI=1S/C30H46O4/c1-16(2)17-9-10-20-28(6)14-19(32)24-25(29(28,7)15-23(34)30(17,20)8)18(31)13-21-26(3,4)22(33)11-12-27(21,24)5/h16-17,20-23,33-34H,9-15H2,1-8H3/t17-,20+,21+,22-,23-,27+,28+,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=C(C(=O)C[C@@]21C)[C@@]1(C)CC[C@@H](O)C(C)(C)[C@@H]1CC3=O,C30H46O4,pos_2_1proton1sodium,470.339609952,YEUIANWBIIZWTM,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 3407,5050,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.5937604,ISDB,ZJIVEFDADFTLMI-ULWTYWRYSA-N,"InChI=1S/C15H24O2/c1-8-5-9(16)6-10-12(17)7-11-13(14(11,2)3)15(8,10)4/h6,8-9,11-13,16-17H,5,7H2,1-4H3/t8-,9-,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2[C@@H](O)C[C@@H]3[C@@H](C3(C)C)[C@]21C,C15H24O2,,236.177630008,ZJIVEFDADFTLMI,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,2,9.375041484832764 3408,5043,-1,,,,0.24645148,ISDB,UUYGQNWMNPMULJ-AWQFTUOYSA-N,"InChI=1S/C19H30N2O12/c1-8(22)13(17(28)29)21-10-4-19(30,3-9(16(10)31-2)20-5-12(24)25)7-33-18-15(27)14(26)11(23)6-32-18/h4,8,11,13-16,18,21-23,26-27,30H,3,5-7H2,1-2H3,(H,24,25)(H,28,29)/b20-9+",COC1C(NC(C(=O)O)C(C)O)=CC(O)(COC2OCC(O)C(O)C2O)C/C1=N\CC(=O)O,C19H30N2O12,,478.1798744,UUYGQNWMNPMULJ,Amino acids and Peptides,,,Nostoc,893787.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Nostoc'],['Unknown'],0,0,0.9858059287071228 3409,5043,-1,,,,0.24645148,ISDB,UUYGQNWMNPMULJ-UHFFFAOYSA-N,"InChI=1S/C19H30N2O12/c1-8(22)13(17(28)29)21-10-4-19(30,3-9(16(10)31-2)20-5-12(24)25)7-33-18-15(27)14(26)11(23)6-32-18/h4,8,11,13-16,18,21-23,26-27,30H,3,5-7H2,1-2H3,(H,24,25)(H,28,29)",COC1C(NC(C(=O)O)C(C)O)=CC(O)(COC2OCC(O)C(O)C2O)CC1=NCC(=O)O,C19H30N2O12,,478.1798744,UUYGQNWMNPMULJ,Amino acids and Peptides,,,Nostoc commune,893796.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Nostoc'],['Nostoc commune'],0,0,0.9858059287071228 3410,5035,-1,,,,0.0,MS1_match,SFLJKERWIWKVDG-TVAJMVSCSA-N,"InChI=1S/C16H26O10/c1-15(22)7-5-24-14(21)16(2,23)6(7)3-9(15)26-13-12(20)11(19)10(18)8(4-17)25-13/h6-13,17-20,22-23H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15-,16-/m0/s1",C[C@@]1(O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@H]2[C@@H]1COC(=O)[C@@]2(C)O,C16H26O10,pos_1_1proton1acetonitrile,378.152597032,SFLJKERWIWKVDG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 3411,5034,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JHUMCHQLYHVEBX-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(8-29-21-19(28)18(27)17(26)15(7-22)31-21)3-4-11-12(23)6-14(25)16-13(24)5-10(2)30-20(11)16/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(C)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O10,pos_1_1proton,438.152597032,JHUMCHQLYHVEBX,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 3412,5034,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIPLCTWVYHJTQK-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(7-22)3-4-11-14(6-13(25)16-12(24)5-10(2)29-20(11)16)30-21-19(28)18(27)17(26)15(8-23)31-21/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(C)oc12)CO,C21H26O10,pos_1_1proton,438.152597032,QIPLCTWVYHJTQK,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 3413,5034,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIPLCTWVYHJTQK-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(7-22)3-4-11-14(6-13(25)16-12(24)5-10(2)29-20(11)16)30-21-19(28)18(27)17(26)15(8-23)31-21/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(C)oc12)CO,C21H26O10,pos_1_1proton,438.152597032,QIPLCTWVYHJTQK,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 3414,5033,-1,,,,0.0,MS1_match,GESDPGMCBUDDMA-NSWVMONVSA-N,"InChI=1S/C31H36O17/c1-43-19-11-15(2-6-16(19)33)4-8-22(35)44-13-21-25(38)27(40)28(41)30(47-21)45-18-7-3-14(10-17(18)34)5-9-23(36)48-31-29(42)26(39)24(37)20(12-32)46-31/h2-11,20-21,24-34,37-42H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24-,25-,26+,27+,28-,29-,30-,31+/m1/s1",COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](Oc3ccc(/C=C/C(=O)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3O)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O,C31H36O17,pos_1_1proton1ammonium,680.1952496920002,GESDPGMCBUDDMA,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3415,5032,476,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1proton1ammonium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 3416,5031,137,Alkaloids,Lysine alkaloids,Polyamines,0.0,MS1_match,YNZFPBWLANBKMU-FTOZMJLYSA-N,"InChI=1S/C38H46O9/c1-8-23(2)34(41)45-31-30-32(43-25(4)39)38(47-36(30,5)6)24(3)19-21-28(44-29(40)22-20-26-15-11-9-12-16-26)37(38,7)33(31)46-35(42)27-17-13-10-14-18-27/h9-18,20,22-24,28,30-33H,8,19,21H2,1-7H3/b22-20+/t23-,24-,28+,30-,31-,32-,33-,37+,38-/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1[C@@H]2[C@@H](OC(C)=O)[C@]3(OC2(C)C)[C@H](C)CC[C@H](OC(=O)/C=C/c2ccccc2)[C@@]3(C)[C@@H]1OC(=O)c1ccccc1,C38H46O9,pos_2_2proton,646.314183052,YNZFPBWLANBKMU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,6.0 3417,5028,-1,,,,0.45717221,ISDB,BYHJHXPTQMMKCA-UHFFFAOYSA-N,"InChI=1S/C11H12N2O4/c12-8(11(16)17)5-10(15)7-3-1-2-4-9(7)13-6-14/h1-4,6,8H,5,12H2,(H,13,14)(H,16,17)",NC(CC(=O)c1ccccc1NC=O)C(=O)O,C11H12N2O4,,236.079706864,BYHJHXPTQMMKCA,Amino acids and Peptides,Small peptides,Aminoacids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,5.828688859939575 3418,5025,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,FZLZHFMMPIVMNA-UHFFFAOYSA-N,"InChI=1S/C35H52O8/c1-18-13-35(28-32(6,43-28)17-40-35)42-20-14-31(5)22-8-7-21-29(2,3)23(41-27-26(38)25(37)19(36)15-39-27)9-10-33(21)16-34(22,33)12-11-30(31,4)24(18)20/h8,18-21,23-28,36-38H,7,9-17H2,1-6H3",CC1CC2(OCC3(C)OC32)OC2CC3(C)C4=CCC5C(C)(C)C(OC6OCC(O)C(O)C6O)CCC56CC46CCC3(C)C12,C35H52O8,pos_1_1proton,600.366218624,FZLZHFMMPIVMNA,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,1,6.5 3419,5025,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,FZLZHFMMPIVMNA-OZJLMKSTSA-N,"InChI=1S/C35H52O8/c1-18-13-35(28-32(6,43-28)17-40-35)42-20-14-31(5)22-8-7-21-29(2,3)23(41-27-26(38)25(37)19(36)15-39-27)9-10-33(21)16-34(22,33)12-11-30(31,4)24(18)20/h8,18-21,23-28,36-38H,7,9-17H2,1-6H3/t18-,19-,20+,21+,23+,24+,25+,26-,27+,28+,30-,31+,32+,33-,34+,35-/m1/s1",C[C@@H]1C[C@@]2(OC[C@]3(C)O[C@H]23)O[C@H]2C[C@@]3(C)C4=CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]3(C)[C@@H]12,C35H52O8,pos_1_1proton,600.366218624,FZLZHFMMPIVMNA,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea asiatica,462241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea asiatica'],6,1,6.5 3420,5025,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,AYQRZIHVNBUHFB-YPDXQIASSA-N,"InChI=1S/C35H52O8/c1-18-12-24-29(32(4,5)39)43-35(42-24)17-33(6)14-20-8-10-22-19(13-21(20)15-34(33,7)28(18)35)9-11-25(31(22,2)3)41-30-27(38)26(37)23(36)16-40-30/h8-9,15,18,22-30,36-39H,10-14,16-17H2,1-7H3/t18-,22+,23+,24+,25-,26+,27-,28-,29-,30+,33-,34+,35+/m1/s1",C[C@@H]1C[C@@H]2O[C@@]3(C[C@@]4(C)CC5=CC[C@H]6C(=CC[C@@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)C6(C)C)CC5=C[C@@]4(C)[C@@H]13)O[C@H]2C(C)(C)O,C35H52O8,pos_1_1proton,600.366218624,AYQRZIHVNBUHFB,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,1,6.5 3421,5025,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,AYQRZIHVNBUHFB-YPDXQIASSA-N,"InChI=1S/C35H52O8/c1-18-12-24-29(32(4,5)39)43-35(42-24)17-33(6)14-20-8-10-22-19(13-21(20)15-34(33,7)28(18)35)9-11-25(31(22,2)3)41-30-27(38)26(37)23(36)16-40-30/h8-9,15,18,22-30,36-39H,10-14,16-17H2,1-7H3/t18-,22+,23+,24+,25-,26+,27-,28-,29-,30+,33-,34+,35+/m1/s1",C[C@@H]1C[C@@H]2O[C@@]3(C[C@@]4(C)CC5=CC[C@H]6C(=CC[C@@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)C6(C)C)CC5=C[C@@]4(C)[C@@H]13)O[C@H]2C(C)(C)O,C35H52O8,pos_1_1proton,600.366218624,AYQRZIHVNBUHFB,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,1,6.5 3422,5025,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,YPGMQGITTGQZFY-FOVWXURSSA-N,"InChI=1S/C35H52O8/c1-18-14-24-29(32(4,5)39)43-35(42-24)17-34(7)22-10-9-21-19(15-20(22)12-13-33(34,6)28(18)35)8-11-25(31(21,2)3)41-30-27(38)26(37)23(36)16-40-30/h8,10,12,18,21,23-30,36-39H,9,11,13-17H2,1-7H3/t18-,21-,23-,24-,25+,26+,27-,28-,29-,30+,33-,34+,35-/m1/s1",C[C@@H]1C[C@H]2O[C@]3(C[C@@]4(C)C5=CC[C@@H]6C(=CC[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)C6(C)C)CC5=CC[C@]4(C)[C@@H]13)O[C@H]2C(C)(C)O,C35H52O8,pos_1_1proton,600.3662186239999,YPGMQGITTGQZFY,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,1,6.5 3423,5025,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,YPGMQGITTGQZFY-FOVWXURSSA-N,"InChI=1S/C35H52O8/c1-18-14-24-29(32(4,5)39)43-35(42-24)17-34(7)22-10-9-21-19(15-20(22)12-13-33(34,6)28(18)35)8-11-25(31(21,2)3)41-30-27(38)26(37)23(36)16-40-30/h8,10,12,18,21,23-30,36-39H,9,11,13-17H2,1-7H3/t18-,21-,23-,24-,25+,26+,27-,28-,29-,30+,33-,34+,35-/m1/s1",C[C@@H]1C[C@H]2O[C@]3(C[C@@]4(C)C5=CC[C@@H]6C(=CC[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)C6(C)C)CC5=CC[C@]4(C)[C@@H]13)O[C@H]2C(C)(C)O,C35H52O8,pos_1_1proton,600.3662186239999,YPGMQGITTGQZFY,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,1,6.5 3424,5021,-1,,,,0.0,MS1_match,YUTFBICAYRWLGQ-UHFFFAOYSA-N,"InChI=1S/C11H14O4/c1-13-10(12)8-4-6-9(7-5-8)11(14-2)15-3/h4-7,11H,1-3H3",COC(=O)c1ccc(C(OC)OC)cc1,C11H14O4,pos_1_1proton2acetonitrile,210.089208928,YUTFBICAYRWLGQ,Shikimates and Phenylpropanoids,,,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 3425,5021,-1,,,,0.0,MS1_match,YUTFBICAYRWLGQ-UHFFFAOYSA-N,"InChI=1S/C11H14O4/c1-13-10(12)8-4-6-9(7-5-8)11(14-2)15-3/h4-7,11H,1-3H3",COC(=O)c1ccc(C(OC)OC)cc1,C11H14O4,pos_1_1proton2acetonitrile,210.089208928,YUTFBICAYRWLGQ,Shikimates and Phenylpropanoids,,,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 3426,5021,-1,,,,0.0,MS1_match,KBMHMJUDNKXZBG-UHFFFAOYSA-N,"InChI=1S/C13H17NO4/c1-14-6-5-8-9(13(14)15)7-10(16-2)12(18-4)11(8)17-3/h7H,5-6H2,1-4H3",COc1cc2c(c(OC)c1OC)CCN(C)C2=O,C13H17NO4,pos_1_1proton1acetonitrile,251.115758024,KBMHMJUDNKXZBG,Alkaloids,,,Thalictrum fendleri,500543.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fendleri'],6,0,6.0 3427,5021,-1,,,,0.0,MS1_match,LNLNPACYBBAULC-KVUDJWBSSA-N,"InChI=1S/C31H44N2O6/c1-5-33-16-29(39-15-22(34)17-8-6-7-9-21(17)32)11-10-25(37-3)31-19-12-18-23(36-2)14-30(35,26(19)27(18)38-4)20(28(31)33)13-24(29)31/h6-9,18-20,23-28,35H,5,10-16,32H2,1-4H3/t18-,19-,20+,23+,24-,25+,26-,27+,28-,29-,30+,31-/m1/s1",CCN1C[C@]2(OCC(=O)c3ccccc3N)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C31H44N2O6,pos_2_2sodium,540.3199371279999,LNLNPACYBBAULC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 3428,5019,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,PIJWCPNNZULZBH-GRYWMYPUSA-N,"InChI=1S/C18H28O12/c1-7(20)12-8(4-11(21)26-2)9(16(25)27-3)6-28-17(12)30-18-15(24)14(23)13(22)10(5-19)29-18/h6-8,10,12-15,17-20,22-24H,4-5H2,1-3H3/t7-,8+,10+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C[C@@H]1C(C(=O)OC)=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1[C@H](C)O,C18H28O12,pos_2_2proton2acetonitrile,436.158076336,PIJWCPNNZULZBH,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],7,3,8.5 3429,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 3430,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum faberi,6133309.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum faberi'],6,0,6.0 3431,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum microgynum,6133338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum microgynum'],6,0,6.0 3432,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum foetidum,98303.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foetidum'],6,0,6.0 3433,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum sultanabadense,6133383.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum sultanabadense'],6,0,6.0 3434,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,0,6.0 3435,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lankesteri,782608.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lankesteri'],6,0,6.0 3436,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum petaloideum,977693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum petaloideum'],6,0,6.0 3437,5018,-1,,,,0.0,MS1_match,HKAAPKXOAPZXLY-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)19-24-10-13-31(42-3)33(20-24)47-26-11-8-23(9-12-26)18-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(OC)c(OC)c(OC)c3Oc3cc4c(cc3OC)CCN(C)[C@H]4C2)CCN1C,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,HKAAPKXOAPZXLY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum alpinum,468431.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum alpinum'],6,0,6.0 3438,5018,-1,,,,0.0,MS1_match,HKAAPKXOAPZXLY-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)19-24-10-13-31(42-3)33(20-24)47-26-11-8-23(9-12-26)18-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(OC)c(OC)c(OC)c3Oc3cc4c(cc3OC)CCN(C)[C@H]4C2)CCN1C,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,HKAAPKXOAPZXLY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum cultratum,583170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum cultratum'],6,0,6.0 3439,5018,-1,,,,0.0,MS1_match,HKAAPKXOAPZXLY-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)19-24-10-13-31(42-3)33(20-24)47-26-11-8-23(9-12-26)18-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(OC)c(OC)c(OC)c3Oc3cc4c(cc3OC)CCN(C)[C@H]4C2)CCN1C,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,HKAAPKXOAPZXLY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 3440,5018,-1,,,,0.0,MS1_match,HKAAPKXOAPZXLY-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)19-24-10-13-31(42-3)33(20-24)47-26-11-8-23(9-12-26)18-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(OC)c(OC)c(OC)c3Oc3cc4c(cc3OC)CCN(C)[C@H]4C2)CCN1C,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,HKAAPKXOAPZXLY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum rugosum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 3441,5018,-1,,,,0.0,MS1_match,HKAAPKXOAPZXLY-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)19-24-10-13-31(42-3)33(20-24)47-26-11-8-23(9-12-26)18-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(OC)c(OC)c(OC)c3Oc3cc4c(cc3OC)CCN(C)[C@H]4C2)CCN1C,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,HKAAPKXOAPZXLY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum javanicum,124737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum javanicum'],6,0,6.0 3442,5018,-1,,,,0.0,MS1_match,HKAAPKXOAPZXLY-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)19-24-10-13-31(42-3)33(20-24)47-26-11-8-23(9-12-26)18-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(OC)c(OC)c(OC)c3Oc3cc4c(cc3OC)CCN(C)[C@H]4C2)CCN1C,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,HKAAPKXOAPZXLY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum revolutum,421843.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum revolutum'],6,0,6.0 3443,5018,-1,,,,0.0,MS1_match,GZMWREWTPLOYPS-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-14-12-23-17-32(43-3)31(42)20-26(23)29(40)16-22-8-10-25(11-9-22)48-37-28-19-30-35-24(13-15-41(30)2)18-33(44-4)38(46-6)36(35)27(28)21-34(45-5)39(37)47-7/h8-11,17-18,20-21,29-30,42H,12-16,19H2,1-7H3/t29-,30-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(Oc3c4c(cc(OC)c3OC)-c3c(OC)c(OC)cc5c3[C@H](C4)N(C)CC5)cc1)N(C)CC2,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,GZMWREWTPLOYPS,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum faberi,6133309.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum faberi'],6,0,6.0 3444,5018,-1,,,,0.0,MS1_match,HKAAPKXOAPZXLY-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)19-24-10-13-31(42-3)33(20-24)47-26-11-8-23(9-12-26)18-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(OC)c(OC)c(OC)c3Oc3cc4c(cc3OC)CCN(C)[C@H]4C2)CCN1C,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,HKAAPKXOAPZXLY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum foetidum,98303.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foetidum'],6,0,6.0 3445,5018,-1,,,,0.0,MS1_match,GZMWREWTPLOYPS-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-14-12-23-17-32(43-3)31(42)20-26(23)29(40)16-22-8-10-25(11-9-22)48-37-28-19-30-35-24(13-15-41(30)2)18-33(44-4)38(46-6)36(35)27(28)21-34(45-5)39(37)47-7/h8-11,17-18,20-21,29-30,42H,12-16,19H2,1-7H3",COc1cc2c(cc1O)C(Cc1ccc(Oc3c4c(cc(OC)c3OC)-c3c(OC)c(OC)cc5c3C(C4)N(C)CC5)cc1)N(C)CC2,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,GZMWREWTPLOYPS,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum cultratum,583170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum cultratum'],6,0,6.0 3446,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum hernandezii,98299.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum hernandezii'],6,0,6.0 3447,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum atriplex,871204.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum atriplex'],6,0,6.0 3448,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum alpinum,468431.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum alpinum'],6,0,6.0 3449,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum foetidum,98303.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foetidum'],6,0,6.0 3450,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,0,6.0 3451,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 3452,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum foliolosum,124406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foliolosum'],6,0,6.0 3453,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum fargesii,124386.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fargesii'],6,0,6.0 3454,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,0,6.0 3455,5018,-1,,,,0.0,MS1_match,SVQMVSCWYACSCP-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.3148517479999,SVQMVSCWYACSCP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum cultratum,583170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum cultratum'],6,0,6.0 3456,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum delavayi,619774.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum delavayi'],6,0,6.0 3457,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum glandulosissimum,5728052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum glandulosissimum'],6,0,6.0 3458,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum alpinum,468431.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum alpinum'],6,0,6.0 3459,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum podocarpum,119512.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum podocarpum'],6,0,6.0 3460,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus var. hypoleucum,300814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 3461,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-UHFFFAOYSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3",COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum foliolosum,124406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foliolosum'],6,0,6.0 3462,5018,-1,,,,0.0,MS1_match,FUZMQNZACIFDBL-KYJUHHDHSA-N,"InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,FUZMQNZACIFDBL,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum fendleri,500543.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fendleri'],6,0,6.0 3463,5018,-1,,,,0.0,MS1_match,DNVRACCNTZAQFE-ACHIHNKUSA-N,"InChI=1S/C39H44N2O7/c1-40-15-13-26-20-34(43-4)35(44-5)21-29(26)31(40)18-25-9-12-33(42-3)36(19-25)48-27-10-7-24(8-11-27)17-32-30-22-37-39(47-23-46-37)38(45-6)28(30)14-16-41(32)2/h7-12,19-22,31-32H,13-18,23H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1OC)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc6c(c(OC)c5CCN4C)OCO6)cc3)c1)N(C)CC2,C39H44N2O7,pos_2_2proton2acetonitrile,652.314851748,DNVRACCNTZAQFE,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum atriplex,871204.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum atriplex'],6,0,6.0 3464,5013,57,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.2472445,ISDB,YCUBHAWXGLKZIA-KUIZHMCLSA-N,"InChI=1S/C38H64O8/c1-22(12-11-16-34(2,3)44-10)23-15-17-38(8)32-26(43-9)20-25-24(36(32,6)18-19-37(23,38)7)13-14-28(35(25,4)5)46-33-31(42)30(41)29(40)27(21-39)45-33/h11,16,20,22-24,26-33,39-42H,12-15,17-19,21H2,1-10H3/b16-11+/t22-,23-,24-,26-,27-,28+,29-,30-,31-,32-,33+,36+,37-,38+/m1/s1",CO[C@@H]1C=C2[C@@H](CC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)C2(C)C)[C@]2(C)CC[C@]3(C)[C@@H]([C@H](C)C/C=C/C(C)(C)OC)CC[C@@]3(C)[C@H]12,C38H64O8,,648.460119008,YCUBHAWXGLKZIA,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Momordica charantia,955521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Momordiceae'],['Momordica'],['Momordica charantia'],4,2,5.988978028297424 3465,5010,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,XHUBSJRBOQIZNI-UHFFFAOYSA-N,"InChI=1S/C9H12O3/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,10-11H,4-5H2,1H3",COc1cc(CCO)ccc1O,C9H12O3,pos_1_1proton2acetonitrile,168.078644244,XHUBSJRBOQIZNI,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 3466,5009,-1,,,,0.0,MS1_match,WFNLLLYWGLKLJX-URWUWABHSA-N,"InChI=1S/C17H26O8/c1-16(2)5-8(6-17(3)10(16)4-11(19)25-17)23-15-14(22)13(21)12(20)9(7-18)24-15/h4,8-9,12-15,18,20-22H,5-7H2,1-3H3/t8-,9+,12+,13-,14+,15-,17+/m0/s1",CC1(C)C[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@]2(C)OC(=O)C=C12,C17H26O8,pos_1_1proton1ammonium,358.162767792,WFNLLLYWGLKLJX,Terpenoids,Apocarotenoids,Megastigmanes,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 3467,5009,-1,,,,0.0,MS1_match,OJHBIIMDJHZZCQ-GOSISDBHSA-N,"InChI=1S/C19H29N3O2/c1-16(23)22-12-6-5-10-20-15-18(17-8-3-2-4-9-17)14-19(24)21-11-7-13-22/h2-4,8-9,18,20H,5-7,10-15H2,1H3,(H,21,24)/t18-/m1/s1",CC(=O)N1CCCCNC[C@H](c2ccccc2)CC(=O)NCCC1,C19H29N3O2,pos_1_minus1proton2sodium,331.225977168,OJHBIIMDJHZZCQ,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Maytenus buxifolia,1060181.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus buxifolia'],6,0,6.0 3468,5008,117,,,,0.61167437,ISDB,,,,,,,WIHSZOXPODIZSW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.446697473526001 3469,5006,-1,,,,0.0,MS1_match,XRIDGQVLGQMCMX-OLEFQQMKSA-N,"InChI=1S/C15H16O7/c1-20-12-6-9(2-4-10(12)16)3-5-14(18)21-8-13-11(17)7-15(19)22-13/h2-6,11,13,16-17H,7-8H2,1H3/b5-3+/t11-,13+/m0/s1",COc1cc(/C=C/C(=O)OC[C@H]2OC(=O)C[C@@H]2O)ccc1O,C15H16O7,pos_1_1proton1ammonium,308.089602852,XRIDGQVLGQMCMX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 3470,5005,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.770679,ISDB,DLDZDBDYUZLISX-QGZVFWFLSA-N,"InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m1/s1",COc1ccc(C[C@@H]2c3cc(O)c(OC)cc3CCN2C)cc1,C19H23NO3,,313.167793596,DLDZDBDYUZLISX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Aconitum leucostomum,723178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum leucostomum'],6,3,10.58271598815918 3471,5003,-1,,,,0.317349,ISDB,,,,,,,AMZCHEDPEAQEMC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2693959474563599 3472,5001,-1,,,,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1potassium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3473,5001,-1,,,,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1potassium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3474,4999,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5359829,ISDB,TZAXQHDIMDQXRD-YJQAKTFBSA-N,"InChI=1S/C19H22O5/c1-4-9-18-10-5-6-16(21)19(18,22)24-17(12(18)2)13-7-8-14(20)15(11-13)23-3/h4-8,11-12,17,20,22H,1,9-10H2,2-3H3/t12-,17+,18-,19-/m1/s1",C=CC[C@]12CC=CC(=O)[C@@]1(O)O[C@H](c1ccc(O)c(OC)c1)[C@H]2C,C19H22O5,,330.146723804,TZAXQHDIMDQXRD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Aniba ferrea,6025335.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Aniba'],['Aniba ferrea'],4,3,7.64393162727356 3475,4998,-1,,,,0.6582409,ISDB,WUOACPNHFRMFPN-UHFFFAOYSA-N,"InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3",CC1=CCC(C(C)(C)O)CC1,C10H18O,,154.135765196,WUOACPNHFRMFPN,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,9.63296365737915 3476,4996,-1,,,,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_1_1proton1methanol,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 3477,4996,-1,,,,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_1_1proton1methanol,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3478,4992,514,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,3,8.5 3479,4992,514,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,3,8.5 3480,4991,-1,,,,0.0,MS1_match,SFLJKERWIWKVDG-TVAJMVSCSA-N,"InChI=1S/C16H26O10/c1-15(22)7-5-24-14(21)16(2,23)6(7)3-9(15)26-13-12(20)11(19)10(18)8(4-17)25-13/h6-13,17-20,22-23H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15-,16-/m0/s1",C[C@@]1(O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@H]2[C@@H]1COC(=O)[C@@]2(C)O,C16H26O10,pos_1_1proton1acetonitrile,378.152597032,SFLJKERWIWKVDG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 3481,4990,-1,,,,0.0,MS1_match,TWUZWTIVCCRAAD-SNVBAGLBSA-N,"InChI=1S/C10H16O7/c1-2-3-4-17-8(13)6-10(16,9(14)15)5-7(11)12/h16H,2-6H2,1H3,(H,11,12)(H,14,15)/t10-/m1/s1",CCCCOC(=O)C[C@](O)(CC(=O)O)C(=O)O,C10H16O7,pos_1_1proton1methanol,248.089602852,TWUZWTIVCCRAAD,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3482,4988,-1,,,,0.0,MS1_match,OUWXZGMEFZQYEK-WQLSENKSSA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(8-12(4)16(17)18)15-11(3)7-10(2)14(9)15/h8-10,13-14H,5-7H2,1-4H3,(H,17,18)/b12-8-",CC1=C2C(/C=C(/C)C(=O)O)CCC(C)C2C(C)C1,C16H24O2,pos_2_1proton1sodium,248.177630008,OUWXZGMEFZQYEK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3483,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 3484,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis fawcettii,5737776.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis fawcettii'],8,0,8.0 3485,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis flammula,3945102.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis flammula'],8,0,8.0 3486,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis gentianoides,72780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis gentianoides'],8,0,8.0 3487,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis glycinoides,842003.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis glycinoides'],8,0,8.0 3488,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis aristata,5737721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis aristata'],8,0,8.0 3489,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis microphylla,32689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis microphylla'],8,0,8.0 3490,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis pubescens,446571.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis pubescens'],8,0,8.0 3491,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3492,4986,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1methanol,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],8,0,8.0 3493,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-LZIBPDADSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,3,8.5 3494,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-YDOLDEOXSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520001,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 3495,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-LZIBPDADSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,3,8.5 3496,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-YDOLDEOXSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520001,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 3497,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,FYSAXYBPXKLMJO-IFECXJOTSA-N,"InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520004,FYSAXYBPXKLMJO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,3,8.5 3498,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,FYSAXYBPXKLMJO-IFECXJOTSA-N,"InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520004,FYSAXYBPXKLMJO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 3499,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone multifida,896056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone multifida'],7,3,8.5 3500,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone narcissiflora,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,3,8.5 3501,4985,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum narcissiflorum,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,3,8.5 3502,4981,1455,Alkaloids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-LDBVRRDLSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,3,7.5 3503,4981,1455,Alkaloids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-LQLJJDJVSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20+,21-,22+,23+/m0/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.126776208,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,3,7.5 3504,4981,1455,Alkaloids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-LDBVRRDLSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,3,7.5 3505,4981,1455,Alkaloids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-LQLJJDJVSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20+,21-,22+,23+/m0/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.126776208,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,3,7.5 3506,4974,637,Carbohydrates,Monoterpenoids,Iridoids monoterpenoids,0.35606763,ISDB,ILKCZSIFTWFKAX-HEUMWBDUSA-N,"InChI=1S/C12H20O9/c13-3-6-8(17)9(18)10(19)12(20-6)21-11-5(15)2-1-4(14)7(11)16/h1-2,4-19H,3H2/t4-,5+,6+,7-,8+,9-,10+,11-,12-/m0/s1",OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)C=C[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C12H20O9,,308.11073222,ILKCZSIFTWFKAX,Carbohydrates,Saccharides,,Vincetoxicum tanakae,204104.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Vincetoxicum'],['Vincetoxicum tanakae'],4,1,5.924270510673523 3507,4972,45,Fatty acids,Fatty Acids and Conjugates,,0.0,MS1_match,RKMQRPYLPSKVNS-UHFFFAOYSA-N,"InChI=1S/C6H10O4/c1-10-6(9)3-2-5(8)4-7/h7H,2-4H2,1H3",COC(=O)CCC(=O)CO,C6H10O4,pos_1_1proton1acetonitrile,146.0579088,RKMQRPYLPSKVNS,Fatty acids,Fatty Acids and Conjugates,,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,2,9.0 3508,4968,-1,,,,0.20160392,ISDB,,,,,,,GOUWYJRGOSCUHQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8064156770706177 3509,4967,877,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.3014329,ISDB,PSQYTAPXSHCGMF-BQYQJAHWSA-N,"InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+",CC(=O)/C=C/C1=C(C)CCCC1(C)C,C13H20O,,192.15141526,PSQYTAPXSHCGMF,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.705731630325317 3510,4966,-1,,,,0.0,MS1_match,AXUYMUBJXHVZEL-DBOUUHTQSA-N,"InChI=1S/C30H42O11/c1-27-8-5-19-20(30(27,38)11-7-18(27)16-2-3-22(33)39-14-16)6-10-29(37)12-17(4-9-28(19,29)15-32)40-26-25(36)24(35)23(34)21(13-31)41-26/h2-3,14-15,17-21,23-26,31,34-38H,4-13H2,1H3/t17-,18+,19-,20+,21+,23+,24-,25+,26+,27+,28-,29-,30-/m0/s1",C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]34C=O)[C@@]1(O)CC[C@@H]2c1ccc(=O)oc1,C30H42O11,pos_1_1proton1acetonitrile,578.2727121639999,AXUYMUBJXHVZEL,Terpenoids,Steroids,Bufadienolides,Helleborus orientalis,648046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus orientalis'],6,0,6.0 3511,4966,-1,,,,0.0,MS1_match,QRFYVPVSGUSPHI-SEIYVQFCSA-N,"InChI=1S/C30H42O11/c1-15-23(34)24(35)25(36)26(40-15)41-17-5-9-28(14-31)18-6-8-27(2)22(16-3-4-21(33)39-13-16)20(32)12-30(27,38)19(18)7-10-29(28,37)11-17/h3-4,13-15,17-20,22-26,32,34-38H,5-12H2,1-2H3/t15-,17-,18-,19+,20-,22-,23-,24+,25+,26-,27+,28-,29-,30-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@@H](c6ccc(=O)oc6)[C@@H](O)C[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C30H42O11,pos_1_1proton1acetonitrile,578.2727121639999,QRFYVPVSGUSPHI,Terpenoids,Steroids,Bufadienolides,Helleborus orientalis,648046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus orientalis'],6,0,6.0 3512,4966,-1,,,,0.0,MS1_match,MYJFNJPQVVCTMB-TWUGUOIISA-N,"InChI=1S/C31H41NO10/c1-8-13(2)25(36)42-19-11-29-21-18-10-28-9-14(3)20(24(31(28,29)38)41-17(6)35)23(40-16(5)34)30(28,37)26(29)32(18)12-27(21,7)22(19)39-15(4)33/h13,18-24,26,37-38H,3,8-12H2,1-2,4-7H3/t13-,18+,19-,20+,21-,22-,23-,24-,26+,27+,28+,29-,30+,31+/m1/s1",C=C1C[C@]23C[C@H]4[C@@H]5[C@]6(C)CN4[C@@H]4[C@@]2(O)[C@H](OC(C)=O)[C@H]1[C@@H](OC(C)=O)[C@@]3(O)[C@]54C[C@@H](OC(=O)[C@H](C)CC)[C@H]6OC(C)=O,C31H41NO10,pos_1_1proton1methanol,587.273046512,MYJFNJPQVVCTMB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glandulosum,260818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida glandulosa'],6,0,6.0 3513,4966,-1,,,,0.0,MS1_match,ORHDQVNYZXBIHU-DKZHOWHKSA-N,"InChI=1S/C31H41NO10/c1-16(33)42-31-18-19(39-3)20-27(15-38-2)11-8-12-28(20,22(18)32-14-27)30(37)13-29(36,25(40-4)23(31)34)24(21(30)31)41-26(35)17-9-6-5-7-10-17/h5-7,9-10,18-25,32,34,36-37H,8,11-15H2,1-4H3/t18-,19-,20+,21-,22+,23-,24+,25-,27-,28+,29+,30-,31-/m0/s1",COC[C@]12CCC[C@]34[C@H](NC1)[C@H]([C@H](OC)[C@H]23)[C@]1(OC(C)=O)[C@H]2[C@@H](OC(=O)c3ccccc3)[C@](O)(C[C@]24O)[C@@H](OC)[C@@H]1O,C31H41NO10,pos_1_1proton1methanol,587.273046512,ORHDQVNYZXBIHU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum polyschistum,6131475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum polyschistum'],6,0,6.0 3514,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 3515,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,0,8.0 3516,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 3517,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3518,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3519,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,0,8.0 3520,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3521,4965,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_1proton1ammonium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3522,4965,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3523,4965,-1,,,,0.0,MS1_match,JIAZWFZSNYBPNC-UHFFFAOYSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)32(48)34(51-21)53-35(49)41-16-14-36(2,3)18-23(41)22-8-9-26-37(4)12-11-27(52-33-31(47)29(45)24(43)19-50-33)38(5,20-42)25(37)10-13-40(26,7)39(22,6)15-17-41/h8,21,23-34,42-48H,9-20H2,1-7H3",CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC4(C)C2(C)CC3)C(O)C(O)C1O,C41H66O12,pos_1_1proton1ammonium,750.455427552,JIAZWFZSNYBPNC,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3524,4965,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3525,4965,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3526,4960,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.5179126,ISDB,GKUSDFCBGXFHIL-CXXZEMTDSA-N,"InChI=1S/C15H18O8/c16-9-4-1-8(2-5-9)3-6-11(17)22-7-10-12(18)13(19)14(20)15(21)23-10/h1-6,10,12-16,18-21H,7H2/b6-3+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O8,,326.1001675359999,GKUSDFCBGXFHIL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,11.571650505065918 3527,4956,-1,,,,0.25401434,ISDB,FVOOCQKPVCFFSH-VPDRPMEHSA-N,"InChI=1S/C33H48O5/c1-19(2)20(3)10-11-22(29(36)37)25-18-28(38-21(4)34)33(9)24-12-13-26-30(5,6)27(35)15-16-31(26,7)23(24)14-17-32(25,33)8/h12,14,19,22,25-26,28H,3,10-11,13,15-18H2,1-2,4-9H3,(H,36,37)/t22-,25-,26+,28+,31-,32-,33-/m1/s1",C=C(CC[C@@H](C(=O)O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C)C(C)C,C33H48O5,,524.3501746359999,FVOOCQKPVCFFSH,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Fomitopsis officinalis,952534.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Polyporales'],['Fomitopsidaceae'],['Unknown'],['Fomitopsis'],['Fomitopsis officinalis'],1,0,2.0160573720932007 3528,4955,506,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.64078915,ISDB,BXIJYKUDHDLSQP-UHFFFAOYSA-N,"InChI=1S/C11H16O2/c1-7(2)9-6-11(13-4)8(3)5-10(9)12/h5-7,12H,1-4H3",COc1cc(C(C)C)c(O)cc1C,C11H16O2,,180.115029752,BXIJYKUDHDLSQP,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Baccharis dracunculifolia,482153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Baccharis'],['Baccharis dracunculifolia'],4,2,7.563156604766846 3529,4952,1417,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.24722394,ISDB,,,,,,,SPOXDTOSLIGBBA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9888957738876343 3530,4950,-1,,,,0.22662815,ISDB,XRIDGQVLGQMCMX-OLEFQQMKSA-N,"InChI=1S/C15H16O7/c1-20-12-6-9(2-4-10(12)16)3-5-14(18)21-8-13-11(17)7-15(19)22-13/h2-6,11,13,16-17H,7-8H2,1H3/b5-3+/t11-,13+/m0/s1",COc1cc(/C=C/C(=O)OC[C@H]2OC(=O)C[C@@H]2O)ccc1O,C15H16O7,,308.089602852,XRIDGQVLGQMCMX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.90651261806488 3531,4949,1317,Shikimates and Phenylpropanoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CRZQGDNQQAALAY-UHFFFAOYSA-N,"InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3",COC(=O)Cc1ccccc1,C9H10O2,pos_1_1proton1methanol,150.06807956,CRZQGDNQQAALAY,Shikimates and Phenylpropanoids,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,1,8.5 3532,4946,-1,,,,0.0,MS1_match,YGSBJLPWANWGED-HYXYOFMCSA-N,"InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_1_1proton1ammonium,942.5188156560004,YGSBJLPWANWGED,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 3533,4946,-1,,,,0.0,MS1_match,YGSBJLPWANWGED-HYXYOFMCSA-N,"InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_1_1proton1ammonium,942.5188156560004,YGSBJLPWANWGED,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3534,4946,-1,,,,0.0,MS1_match,YGSBJLPWANWGED-HYXYOFMCSA-N,"InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_1_1proton1ammonium,942.5188156560004,YGSBJLPWANWGED,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis,964052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Unknown'],8,0,8.0 3535,4944,-1,,,,0.0,MS1_match,VYKGYAQKCAHXKR-RXMQYKEDSA-N,"InChI=1S/C7H13N3O2/c8-7(9)10-3-1-2-5(10)4-6(11)12/h5H,1-4H2,(H3,8,9)(H,11,12)/t5-/m1/s1",N=C(N)N1CCC[C@@H]1CC(=O)O,C7H13N3O2,pos_1_1proton2acetonitrile,171.100776656,VYKGYAQKCAHXKR,Alkaloids,Lysine alkaloids,,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 3536,4943,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_2MNa,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 3537,4943,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_2MNa,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 3538,4943,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_2MNa,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 3539,4943,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_2MNa,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 3540,4943,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_2MNa,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 3541,4943,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_2MNa,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 3542,4942,543,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GFPLPBCJRRNZHM-ICUGHKHQSA-N,"InChI=1S/C53H86O22/c1-23-32(57)36(61)40(65)44(70-23)74-42-33(58)26(56)20-68-46(42)73-31-11-12-49(4)29(50(31,5)22-55)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,17-15-51(24,52)6)47(67)75-45-41(66)38(63)35(60)28(72-45)21-69-43-39(64)37(62)34(59)27(19-54)71-43/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_sodium,1074.5610743920006,GFPLPBCJRRNZHM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,9.5 3543,4942,543,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,UEHILKCNLIKLEV-FMYTYVRISA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26+,27+,28+,29+,30+,31-,32-,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@@H](O)[C@@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_sodium,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,9.5 3544,4942,543,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_sodium,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 3545,4942,543,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_sodium,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,3,9.5 3546,4941,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.64562577,ISDB,USMNOWBWPHYOEA-MRTMQBJTSA-N,"InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1",CC(C)[C@]12CC(=O)[C@H](C)[C@H]1C2,C10H16O,,152.120115132,USMNOWBWPHYOEA,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,2,9.582503080368042 3547,4937,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CRZQGDNQQAALAY-UHFFFAOYSA-N,"InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3",COC(=O)Cc1ccccc1,C9H10O2,pos_1_1proton,150.06807956,CRZQGDNQQAALAY,Shikimates and Phenylpropanoids,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 3548,4935,1491,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,0.0,MS1_match,ONPOXXGCIAQPEL-UHFFFAOYSA-N,"InChI=1S/C12H13NO4/c1-13-4-3-7-8(12(13)14)5-9-11(10(7)15-2)17-6-16-9/h5H,3-4,6H2,1-2H3",COc1c2c(cc3c1OCO3)C(=O)N(C)CC2,C12H13NO4,pos_2MHNH3,235.084457896,ONPOXXGCIAQPEL,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Thalictrum foetidum,98303.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foetidum'],6,3,7.5 3549,4935,1491,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,0.0,MS1_match,ONPOXXGCIAQPEL-UHFFFAOYSA-N,"InChI=1S/C12H13NO4/c1-13-4-3-7-8(12(13)14)5-9-11(10(7)15-2)17-6-16-9/h5H,3-4,6H2,1-2H3",COc1c2c(cc3c1OCO3)C(=O)N(C)CC2,C12H13NO4,pos_2MHNH3,235.084457896,ONPOXXGCIAQPEL,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 3550,4935,1491,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,0.0,MS1_match,ONPOXXGCIAQPEL-UHFFFAOYSA-N,"InChI=1S/C12H13NO4/c1-13-4-3-7-8(12(13)14)5-9-11(10(7)15-2)17-6-16-9/h5H,3-4,6H2,1-2H3",COc1c2c(cc3c1OCO3)C(=O)N(C)CC2,C12H13NO4,pos_2MHNH3,235.084457896,ONPOXXGCIAQPEL,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,3,7.5 3551,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-LZIBPDADSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,3,8.5 3552,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-YDOLDEOXSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520001,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 3553,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-LZIBPDADSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,3,8.5 3554,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,OHJWWOZXCKEOGK-YDOLDEOXSA-N,"InChI=1S/C47H76O16/c1-22-30(50)36(62-38-34(54)33(53)32(52)26(20-48)60-38)35(55)39(59-22)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33-,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520001,OHJWWOZXCKEOGK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 3555,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,FYSAXYBPXKLMJO-IFECXJOTSA-N,"InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520004,FYSAXYBPXKLMJO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,3,8.5 3556,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,FYSAXYBPXKLMJO-IFECXJOTSA-N,"InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.5133363520004,FYSAXYBPXKLMJO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 3557,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone multifida,896056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone multifida'],7,3,8.5 3558,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone narcissiflora,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,3,8.5 3559,4933,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BWNBCQHJURTQKQ-ADNOESIESA-N,"InChI=1S/C47H76O16/c1-22-30(50)32(52)37(63-39-34(54)31(51)25(20-48)59-39)40(58-22)62-36-26(21-49)60-38(35(55)33(36)53)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)O[C@@H]2CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C47H76O16,pos_1_1proton,896.513336352,BWNBCQHJURTQKQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum narcissiflorum,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,3,8.5 3560,4932,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_sodium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 3561,4932,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_sodium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,1,6.5 3562,4931,388,,,,0.23242112,ISDB,WABSIBOPGQPWRD-VQHVLOKHSA-N,"InChI=1S/C14H24O6/c1-19-13(17)8-6-4-2-3-5-7-9-14(18)20-11-12(16)10-15/h7,9,12,15-16H,2-6,8,10-11H2,1H3/b9-7+",COC(=O)CCCCCC/C=C/C(=O)OCC(O)CO,C14H24O6,,288.157288488,WABSIBOPGQPWRD,,,,Cladosporium cladosporioides,187451.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Capnodiales'],['Cladosporiaceae'],['Unknown'],['Cladosporium'],['Cladosporium cladosporioides'],1,0,1.9296844601631165 3563,4930,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,IKIIZLYTISPENI-ZFORQUDYSA-N,"InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2cc3oc(-c4ccccc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O11,pos_1_1proton,446.084911396,IKIIZLYTISPENI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum baicalense,1045100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum baicalense'],6,3,7.5 3564,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,3,7.5 3565,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UHFFFAOYSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)",O=C(C=Cc1ccc(O)c(O)c1)OC(C(=O)O)C(O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.084911396,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,3,7.5 3566,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 3567,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 3568,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 3569,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,3,7.5 3570,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,3,7.5 3571,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 3572,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,3,7.5 3573,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UHFFFAOYSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)",O=C(C=Cc1ccc(O)c(O)c1)OC(C(=O)O)C(O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.084911396,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,3,7.5 3574,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 3575,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 3576,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 3577,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,3,7.5 3578,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,3,7.5 3579,4922,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ACYXDIZTQDLTCB-UVIKLTKHSA-N,"InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O11,pos_1_1proton1acetonitrile,434.0849113959998,ACYXDIZTQDLTCB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 3580,4920,-1,,,,0.0,MS1_match,GREGWBBWKKBCEU-PWXALIIZSA-N,"InChI=1S/C35H38N2O6/c1-37-30(27-10-9-26(41-2)17-24(27)19-35(37)40)15-22-6-11-31(38)34(16-22)43-25-7-4-21(5-8-25)14-29-28-20-32(39)33(42-3)18-23(28)12-13-36-29/h4-11,16-18,20,29-30,35-36,38-40H,12-15,19H2,1-3H3/t29?,30-,35-/m0/s1",COc1ccc2c(c1)C[C@H](O)N(C)[C@H]2Cc1ccc(O)c(Oc2ccc(CC3NCCc4cc(OC)c(O)cc43)cc2)c1,C35H38N2O6,pos_2_2sodium,582.272986936,GREGWBBWKKBCEU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 3581,4919,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.20771468,ISDB,LHFKHAVGGJJQFF-JRNWQWJGSA-N,"InChI=1S/C16H25NO2/c1-4-5-6-7-8-9-10-11-12-13-15(18)17-14-16(2,3)19/h4-9,12-13,19H,10-11,14H2,1-3H3,(H,17,18)/b5-4-,7-6+,9-8-,13-12+",C/C=C\C=C\C=C/CC/C=C/C(=O)NCC(C)(C)O,C16H25NO2,,263.18852904,LHFKHAVGGJJQFF,Fatty acids,Fatty amides,N-acyl amines,Zanthoxylum bungeanum,889918.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum bungeanum'],4,0,4.8308587074279785 3582,4919,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.20771468,ISDB,LHFKHAVGGJJQFF-GUXLVXIJSA-N,"InChI=1S/C16H25NO2/c1-4-5-6-7-8-9-10-11-12-13-15(18)17-14-16(2,3)19/h4-9,12-13,19H,10-11,14H2,1-3H3,(H,17,18)/b5-4?,7-6+,9-8?,13-12?",CC=C/C=C/C=CCCC=CC(=O)NCC(C)(C)O,C16H25NO2,,263.18852904,LHFKHAVGGJJQFF,Fatty acids,Fatty amides,N-acyl amines,Zanthoxylum schinifolium,237365.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum schinifolium'],4,0,4.8308587074279785 3583,4919,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.20771468,ISDB,LHFKHAVGGJJQFF-UMYNZBAMSA-N,"InChI=1S/C16H25NO2/c1-4-5-6-7-8-9-10-11-12-13-15(18)17-14-16(2,3)19/h4-9,12-13,19H,10-11,14H2,1-3H3,(H,17,18)/b5-4+,7-6+,9-8+,13-12+",C/C=C/C=C/C=C/CC/C=C/C(=O)NCC(C)(C)O,C16H25NO2,,263.18852904,LHFKHAVGGJJQFF,Fatty acids,Fatty amides,N-acyl amines,Zanthoxylum piperitum,164606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum piperitum'],4,0,4.8308587074279785 3584,4917,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.0,MS1_match,GEWDNTWNSAZUDX-WQMVXFAESA-N,"InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)OC,C13H20O3,pos_1_1proton1acetonitrile,224.1412445,GEWDNTWNSAZUDX,Fatty acids,Octadecanoids,Jasmonic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3585,4916,-1,,,,0.0,MS1_match,IZQSVPBOUDKVDZ-UHFFFAOYSA-N,"InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3",COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O,C16H12O7,pos_1_sodium,316.058302724,IZQSVPBOUDKVDZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium semibarbatum,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 3586,4916,-1,,,,0.0,MS1_match,IZQSVPBOUDKVDZ-UHFFFAOYSA-N,"InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3",COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O,C16H12O7,pos_1_sodium,316.058302724,IZQSVPBOUDKVDZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium semibarbartum,3944980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbartum'],6,0,6.0 3587,4916,-1,,,,0.0,MS1_match,IZQSVPBOUDKVDZ-UHFFFAOYSA-N,"InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3",COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O,C16H12O7,pos_1_sodium,316.058302724,IZQSVPBOUDKVDZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium zalil,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 3588,4913,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.20454258,ISDB,KMSBNWQKGSLQFA-FVQPYGJLSA-N,"InChI=1S/C42H68O13/c1-21-28(45)30(47)32(49)34(52-21)55-33-31(48)29(46)24(19-43)53-35(33)54-27-11-12-38(4)25(39(27,5)20-44)10-13-41(7)26(38)9-8-22-23-18-37(2,3)14-16-42(23,36(50)51)17-15-40(22,41)6/h8,21,23-35,43-49H,9-20H2,1-7H3,(H,50,51)/t21-,23-,24+,25+,26+,27-,28-,29+,30+,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C42H68O13,,780.4659922360003,KMSBNWQKGSLQFA,Terpenoids,Triterpenoids,Oleanane triterpenoids,Stauntonia hexaphylla,822368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Lardizabalaceae'],['Lardizabaleae'],['Stauntonia'],['Stauntonia hexaphylla'],5,3,7.3181703090667725 3589,4909,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.31689626,ISDB,FESYABODVVRUBU-DPSGVGSGSA-N,"InChI=1S/C42H68O12/c1-21(2)13-15-30(43)23(5)17-19-42(50)29(32(44)25(7)28-12-11-18-41(28,42)10)20-24(6)31(16-14-22(3)4)53-39-37(49)35(47)38(27(9)52-39)54-40-36(48)34(46)33(45)26(8)51-40/h13-14,17,20,25-31,33-40,43,45-50H,11-12,15-16,18-19H2,1-10H3/b23-17+,24-20+/t25-,26-,27+,28-,29-,30+,31-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42-/m0/s1",CC(C)=CC[C@@H](O)/C(C)=C/C[C@]1(O)[C@@H](/C=C(\C)[C@H](CC=C(C)C)O[C@@H]2O[C@H](C)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H]2O)C(=O)[C@@H](C)[C@@H]2CCC[C@@]21C,C42H68O12,,764.471077616,FESYABODVVRUBU,Terpenoids,,,Neopetrosia vanilla,4939023.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Haplosclerida'],['Petrosiidae'],['Unknown'],['Neopetrosia'],['Neopetrosia vanilla'],1,1,2.767585039138794 3590,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,ABRULANJVVJLFI-DGHBBABESA-N,"InChI=1S/C22H22O10/c1-30-13-7-14-16(11(25)6-12(31-14)9-2-4-10(24)5-3-9)19(27)17(13)22-21(29)20(28)18(26)15(8-23)32-22/h2-7,15,18,20-24,26-29H,8H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1methanol,446.1212969039999,ABRULANJVVJLFI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia oxysepala,949638.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia oxysepala'],6,2,7.0 3591,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,ABRULANJVVJLFI-DGHBBABESA-N,"InChI=1S/C22H22O10/c1-30-13-7-14-16(11(25)6-12(31-14)9-2-4-10(24)5-3-9)19(27)17(13)22-21(29)20(28)18(26)15(8-23)32-22/h2-7,15,18,20-24,26-29H,8H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1methanol,446.1212969039999,ABRULANJVVJLFI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Aquilegia oxysepala,949638.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia oxysepala'],6,2,7.0 3592,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HHPLIFSIFJSIBY-UHJXJGFFSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15?,18-,19-,20?,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1OC(CO)[C@H](O)[C@H](O)C1O,C22H22O10,pos_1_1proton1methanol,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,2,7.0 3593,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HHPLIFSIFJSIBY-PGPONNFDSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1methanol,446.1212969039999,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,2,7.0 3594,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HHPLIFSIFJSIBY-RZDNYABWSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18+,19-,20+,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1methanol,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,2,7.0 3595,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HHPLIFSIFJSIBY-UHJXJGFFSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15?,18-,19-,20?,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1OC(CO)[C@H](O)[C@H](O)C1O,C22H22O10,pos_1_1proton1methanol,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,2,7.0 3596,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HHPLIFSIFJSIBY-PGPONNFDSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18-,19+,20-,22+/m1/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1methanol,446.1212969039999,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,2,7.0 3597,4908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HHPLIFSIFJSIBY-RZDNYABWSA-N,"InChI=1S/C22H22O10/c1-30-14-7-12(26)16-11(25)6-13(9-2-4-10(24)5-3-9)31-21(16)17(14)22-20(29)19(28)18(27)15(8-23)32-22/h2-7,15,18-20,22-24,26-29H,8H2,1H3/t15-,18+,19-,20+,22-/m0/s1",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O10,pos_1_1proton1methanol,446.121296904,HHPLIFSIFJSIBY,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,2,7.0 3598,4906,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MK,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3599,4906,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MK,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3600,4906,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MK,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3601,4906,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MK,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3602,4906,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MK,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3603,4906,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MK,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3604,4906,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_2MK,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3605,4906,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_2MK,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3606,4906,-1,,,,0.0,MS1_match,NEVMWOQJRSZYIC-UUANRDTJSA-N,"InChI=1S/C30H36O18/c1-39-13-5-11-6-14(40-2)25(13)47-29-23(35)21(33)19(31)17(45-29)10-44-28(38)12-7-15(41-3)26(16(8-12)42-4)48-30-24(36)22(34)20(32)18(46-30)9-43-27(11)37/h5-8,17-24,29-36H,9-10H2,1-4H3/t17-,18-,19-,20-,21+,22+,23-,24-,29+,30+/m1/s1",COc1cc2cc(OC)c1O[C@@H]1O[C@H](COC(=O)c3cc(OC)c(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C30H36O18,pos_1_1potassium,684.190164312,NEVMWOQJRSZYIC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 3607,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 3608,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,0,8.0 3609,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 3610,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3611,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3612,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,0,8.0 3613,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3614,4900,-1,,,,0.0,MS1_match,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,pos_1_sodium,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3615,4900,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_sodium,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3616,4900,-1,,,,0.0,MS1_match,JIAZWFZSNYBPNC-UHFFFAOYSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)32(48)34(51-21)53-35(49)41-16-14-36(2,3)18-23(41)22-8-9-26-37(4)12-11-27(52-33-31(47)29(45)24(43)19-50-33)38(5,20-42)25(37)10-13-40(26,7)39(22,6)15-17-41/h8,21,23-34,42-48H,9-20H2,1-7H3",CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC4(C)C2(C)CC3)C(O)C(O)C1O,C41H66O12,pos_1_sodium,750.455427552,JIAZWFZSNYBPNC,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3617,4900,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_sodium,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3618,4900,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-LFGJQLCQSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23-,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_sodium,750.4554275520002,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,0,8.0 3619,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis flammula,3945102.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis flammula'],8,0,8.0 3620,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis fawcettii,5737776.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis fawcettii'],8,0,8.0 3621,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis gentianoides,72780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis gentianoides'],8,0,8.0 3622,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis glycinoides,842003.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis glycinoides'],8,0,8.0 3623,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis aristata,5737721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis aristata'],8,0,8.0 3624,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis microphylla,32689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis microphylla'],8,0,8.0 3625,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis pubescens,446571.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis pubescens'],8,0,8.0 3626,4896,-1,,,,0.0,MS1_match,JLUQTCXCAFSSLD-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c11-7-1-3-9(13-7)5-6-10(9)4-2-8(12)14-10/h1-4H,5-6H2",O=C1C=CC2(CCC23C=CC(=O)O3)O1,C10H8O4,pos_2_2proton2acetonitrile,192.042258736,JLUQTCXCAFSSLD,Shikimates and Phenylpropanoids,,,Clematis hirsutissima,3945124.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hirsutissima'],8,0,8.0 3627,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3628,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],8,0,8.0 3629,4896,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 3630,4890,-1,,,,0.0,MS1_match,KAYJMBNCFOBTHX-UHFFFAOYSA-N,"InChI=1S/C38H40N2O6/c1-39-16-14-23-19-33(42-3)31(41)21-27(23)29(39)18-22-10-12-24(13-11-22)46-32-9-7-8-25-28(32)20-30-34-26(15-17-40(30)2)36(43-4)38(45-6)37(44-5)35(25)34/h7-13,19-21,29,41H,14-18H2,1-6H3",COc1cc2c(cc1O)C(Cc1ccc(Oc3cccc4c3cc3c5c(c(OC)c(OC)c(OC)c54)CCN3C)cc1)N(C)CC2,C38H40N2O6,pos_2_2proton,620.288637,KAYJMBNCFOBTHX,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum cultratum,583170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum cultratum'],6,0,6.0 3631,4886,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 3632,4886,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,0,8.0 3633,4886,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 3634,4886,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 3635,4886,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 3636,4886,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,0,8.0 3637,4884,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_sodium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 3638,4884,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_sodium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,1,6.5 3639,4883,637,Carbohydrates,Monoterpenoids,Iridoids monoterpenoids,0.27282435,ISDB,,,,,,,ADHNYKZHPOEULM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0912973880767822 3640,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3641,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],8,0,8.0 3642,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 3643,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,JLUQTCXCAFSSLD-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c11-7-1-3-9(13-7)5-6-10(9)4-2-8(12)14-10/h1-4H,5-6H2",O=C1C=CC2(CCC23C=CC(=O)O3)O1,C10H8O4,pos_2_2proton2acetonitrile,192.042258736,JLUQTCXCAFSSLD,Shikimates and Phenylpropanoids,,,Clematis hirsutissima,3945124.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hirsutissima'],8,0,8.0 3644,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis pubescens,446571.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis pubescens'],8,0,8.0 3645,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis microphylla,32689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis microphylla'],8,0,8.0 3646,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis flammula,3945102.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis flammula'],8,0,8.0 3647,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis glycinoides,842003.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis glycinoides'],8,0,8.0 3648,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis gentianoides,72780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis gentianoides'],8,0,8.0 3649,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis aristata,5737721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis aristata'],8,0,8.0 3650,4882,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis fawcettii,5737776.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis fawcettii'],8,0,8.0 3651,4879,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.5651081,ISDB,VQTFXJZYQVWHJA-UHFFFAOYSA-N,"InChI=1S/C13H14O3/c1-8-6-9-4-5-10(14)13(16-3)12(9)11(7-8)15-2/h4-7,14H,1-3H3",COc1cc(C)cc2ccc(O)c(OC)c12,C13H14O3,,218.094294308,VQTFXJZYQVWHJA,Polyketides,Naphthalenes,Naphthalenes and derivatives,Diospyros celebica,1256.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ebenaceae'],['Unknown'],['Diospyros'],['Diospyros celebica'],4,3,7.760432481765747 3652,4877,692,Shikimates and Phenylpropanoids,Pseudoalkaloids,Cinnamic acids and derivatives,0.0,MS1_match,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,pos_1_1proton2acetonitrile,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,3,7.5 3653,4877,692,Shikimates and Phenylpropanoids,Pseudoalkaloids,Cinnamic acids and derivatives,0.0,MS1_match,QWIIMHNSFMCFHE-IWHNWRMISA-N,"InChI=1S/C17H22O10/c1-26-11-5-8(6-12(27-2)15(11)23)3-4-9(19)13(21)16(24)17(25)14(22)10(20)7-18/h3-6,10,14,16-18,20,22-25H,7H2,1-2H3/b4-3+/t10-,14-,16+,17+/m1/s1",COc1cc(/C=C/C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)cc(OC)c1O,C17H22O10,pos_1_1proton2acetonitrile,386.121296904,QWIIMHNSFMCFHE,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,3,7.5 3654,4874,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.8754678,ISDB,HAIPHKFLSXSDAN-BLOCXYQCSA-N,"InChI=1S/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,31,33,42H,6-7,9,11-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H76NO8P,,777.530855022,HAIPHKFLSXSDAN,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,6.001871109008789 3655,4874,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.8754678,ISDB,HAIPHKFLSXSDAN-BLOCXYQCSA-N,"InChI=1S/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,31,33,42H,6-7,9,11-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H76NO8P,,777.530855022,HAIPHKFLSXSDAN,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,6.001871109008789 3656,4873,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,ZNFRITHWVZXJRK-YHFBEQRYSA-N,"InChI=1S/C36H58O8/c1-31(2)14-16-36(30(41)42)17-15-34(6)20(21(36)18-31)8-9-24-33(5)12-11-25(32(3,4)23(33)10-13-35(24,34)7)44-29-28(40)27(39)26(38)22(19-37)43-29/h8,21-29,37-40H,9-19H2,1-7H3,(H,41,42)/t21-,22+,23-,24+,25-,26+,27-,28+,29-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H58O8,pos_1_1proton,618.413168816,ZNFRITHWVZXJRK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis grata,5922971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis grata'],8,3,9.5 3657,4872,637,Carbohydrates,Monoterpenoids,Iridoids monoterpenoids,0.36094463,ISDB,ILKCZSIFTWFKAX-HEUMWBDUSA-N,"InChI=1S/C12H20O9/c13-3-6-8(17)9(18)10(19)12(20-6)21-11-5(15)2-1-4(14)7(11)16/h1-2,4-19H,3H2/t4-,5+,6+,7-,8+,9-,10+,11-,12-/m0/s1",OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)C=C[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C12H20O9,,308.11073222,ILKCZSIFTWFKAX,Carbohydrates,Saccharides,,Vincetoxicum tanakae,204104.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Vincetoxicum'],['Vincetoxicum tanakae'],4,1,5.9437785148620605 3658,4871,144,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_sodium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 3659,4871,144,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_sodium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 3660,4869,45,Fatty acids,Fatty Acids and Conjugates,,0.0,MS1_match,RKMQRPYLPSKVNS-UHFFFAOYSA-N,"InChI=1S/C6H10O4/c1-10-6(9)3-2-5(8)4-7/h7H,2-4H2,1H3",COC(=O)CCC(=O)CO,C6H10O4,pos_1_1proton1acetonitrile,146.0579088,RKMQRPYLPSKVNS,Fatty acids,Fatty Acids and Conjugates,,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,2,9.0 3661,4868,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,ZNFRITHWVZXJRK-YHFBEQRYSA-N,"InChI=1S/C36H58O8/c1-31(2)14-16-36(30(41)42)17-15-34(6)20(21(36)18-31)8-9-24-33(5)12-11-25(32(3,4)23(33)10-13-35(24,34)7)44-29-28(40)27(39)26(38)22(19-37)43-29/h8,21-29,37-40H,9-19H2,1-7H3,(H,41,42)/t21-,22+,23-,24+,25-,26+,27-,28+,29-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H58O8,pos_1_1proton,618.413168816,ZNFRITHWVZXJRK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis grata,5922971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis grata'],8,3,9.5 3662,4866,603,Fatty acids,Octadecanoids,Jasmonic acids,0.5213565,ISDB,GEWDNTWNSAZUDX-WQMVXFAESA-N,"InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)OC,C13H20O3,,224.1412445,GEWDNTWNSAZUDX,Fatty acids,Octadecanoids,Jasmonic acids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,9.585426092147827 3663,4865,1197,,,,0.2722218,ISDB,SCLGLFRXJNHKQZ-GIBQNNFTSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7+,8-,9+,10-,11+,12+/m0/s1",C[C@@H]1OC=C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Saponaria officinalis,842209.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Saponaria'],['Saponaria officinalis'],4,0,5.0888872146606445 3664,4865,1197,,,,0.2722218,ISDB,SCLGLFRXJNHKQZ-XFLMTTEOSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7+,8+,9+,10-,11+,12+/m0/s1",C[C@@H]1OC=C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Dianthus deltoides,188564.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus deltoides'],4,0,5.0888872146606445 3665,4865,1197,,,,0.2722218,ISDB,SCLGLFRXJNHKQZ-XFLMTTEOSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7+,8+,9+,10-,11+,12+/m0/s1",C[C@@H]1OC=C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Dianthus barbatus,590078.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus barbatus'],4,0,5.0888872146606445 3666,4865,1197,,,,0.2722218,ISDB,SCLGLFRXJNHKQZ-FYKVHUBJSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7-,8-,9-,10+,11-,12-/m1/s1",C[C@H]1OC=C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Dianthus longicalyx,904393.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus longicalyx'],4,0,5.0888872146606445 3667,4864,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GFPLPBCJRRNZHM-ICUGHKHQSA-N,"InChI=1S/C53H86O22/c1-23-32(57)36(61)40(65)44(70-23)74-42-33(58)26(56)20-68-46(42)73-31-11-12-49(4)29(50(31,5)22-55)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,17-15-51(24,52)6)47(67)75-45-41(66)38(63)35(60)28(72-45)21-69-43-39(64)37(62)34(59)27(19-54)71-43/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_1proton1ammonium,1074.5610743920006,GFPLPBCJRRNZHM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,9.5 3668,4864,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,UEHILKCNLIKLEV-FMYTYVRISA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26+,27+,28+,29+,30+,31-,32-,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@@H](O)[C@@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_1proton1ammonium,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,9.5 3669,4864,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_1proton1ammonium,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 3670,4864,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,UEHILKCNLIKLEV-LXABABOZSA-N,"InChI=1S/C53H86O22/c1-23-32(57)35(60)39(64)45(70-23)74-42-27(19-54)71-43(41(66)37(42)62)69-21-28-34(59)36(61)40(65)46(72-28)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-44-38(63)33(58)26(56)20-68-44)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_1_1proton1ammonium,1074.561074392,UEHILKCNLIKLEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,3,9.5 3671,4863,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_1proton1methanol,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 3672,4863,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_1proton1methanol,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 3673,4863,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_1proton1methanol,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,1,6.5 3674,4863,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_1proton1methanol,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,1,6.5 3675,4863,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_1proton1methanol,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,1,6.5 3676,4863,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_1proton1methanol,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,1,6.5 3677,4863,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_1proton1methanol,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,1,6.5 3678,4862,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,RFTKPXQZIVKVOP-PMQCXRHVSA-N,"InChI=1S/C16H20O9/c1-23-10-4-2-8(6-9(10)18)3-5-12(19)25-16-15(22)14(21)13(20)11(7-17)24-16/h2-6,11,13-18,20-22H,7H2,1H3/b5-3+/t11-,13-,14+,15-,16+/m1/s1",COc1ccc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C16H20O9,pos_1_1proton1ammonium,356.11073222,RFTKPXQZIVKVOP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,3,7.5 3679,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 3680,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum henryi,5511349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum henryi'],6,0,6.0 3681,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,0,6.0 3682,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,0,6.0 3683,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 3684,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nevadense,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 3685,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 3686,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,0,6.0 3687,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 3688,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 3689,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 3690,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,0,6.0 3691,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 3692,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tatsienense,413958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tatsienense'],6,0,6.0 3693,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-ISYHQGQGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13?,14-,15+,16?,17-,18?,19?,20?,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CCC(OC)C34C1C(C(OC)[C@@H]32)[C@@]1(O)C[C@H](OC)C2C[C@@H]4[C@@H]1C2O,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 3694,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 3695,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 3696,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-VYPGSPFBSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15-,16-,17-,18+,19-,20-,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,0,6.0 3697,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 3698,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,0,6.0 3699,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JBMHRENUZHIXEX-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-7-26-12-22(2)9-8-16(30-4)24-14-10-13-15(29-3)11-23(27,17(14)18(13)31-5)25(28,21(24)26)20(32-6)19(22)24/h13-21,27-28H,7-12H2,1-6H3",CCN1CC2(C)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,JBMHRENUZHIXEX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 3700,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JBMHRENUZHIXEX-KCOJYJFYSA-N,"InChI=1S/C25H41NO6/c1-7-26-12-22(2)9-8-16(30-4)24-14-10-13-15(29-3)11-23(27,17(14)18(13)31-5)25(28,21(24)26)20(32-6)19(22)24/h13-21,27-28H,7-12H2,1-6H3/t13-,14-,15+,16+,17-,18-,19+,20+,21-,22-,23-,24-,25+/m0/s1",CCN1C[C@]2(C)CC[C@@H](OC)[C@@]34[C@@H]2[C@@H](OC)[C@@](O)([C@@H]13)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2OC,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,JBMHRENUZHIXEX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium dissectum,6131641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium dissectum'],6,0,6.0 3701,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JBMHRENUZHIXEX-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-7-26-12-22(2)9-8-16(30-4)24-14-10-13-15(29-3)11-23(27,17(14)18(13)31-5)25(28,21(24)26)20(32-6)19(22)24/h13-21,27-28H,7-12H2,1-6H3",CCN1CC2(C)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,JBMHRENUZHIXEX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,0,6.0 3702,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VBOMZXYQMCEYLU-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-27)8-7-16(30-3)25-14-9-13-15(29-2)10-24(28,17(14)19(13)31-4)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,VBOMZXYQMCEYLU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,0,6.0 3703,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sungpanense,1042521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sungpanense'],6,0,6.0 3704,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,0,6.0 3705,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DFEZSQMRHFPRME-LNEJQENQSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(27)25-14-9-13-15(30-3)10-24(32-5,17(14)19(13)28)18(22(25)26)20(31-4)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-,25-/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@@H]13)[C@]1(OC)C[C@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DFEZSQMRHFPRME,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,0,6.0 3706,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum volubile,549540.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum volubile'],6,0,6.0 3707,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum volubile,549540.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum volubile'],6,0,6.0 3708,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 3709,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,0,6.0 3710,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sungpanense,1042521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sungpanense'],6,0,6.0 3711,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum henryi,5511349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum henryi'],6,0,6.0 3712,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,0,6.0 3713,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,0,6.0 3714,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 3715,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nevadense,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 3716,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,0,6.0 3717,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VBOMZXYQMCEYLU-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-27)8-7-16(30-3)25-14-9-13-15(29-2)10-24(28,17(14)19(13)31-4)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,VBOMZXYQMCEYLU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 3718,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,0,6.0 3719,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 3720,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 3721,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,0,6.0 3722,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 3723,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tatsienense,413958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tatsienense'],6,0,6.0 3724,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-ISYHQGQGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13?,14-,15+,16?,17-,18?,19?,20?,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CCC(OC)C34C1C(C(OC)[C@@H]32)[C@@]1(O)C[C@H](OC)C2C[C@@H]4[C@@H]1C2O,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 3725,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 3726,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 3727,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-VYPGSPFBSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15-,16-,17-,18+,19-,20-,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,0,6.0 3728,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 3729,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_2_2proton3acetonitrile,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,0,6.0 3730,4861,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_2_2proton3acetonitrile,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 3731,4856,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2486542,ISDB,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,10.49461680650711 3732,4856,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2486542,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,10.49461680650711 3733,4856,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2486542,ISDB,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,10.49461680650711 3734,4856,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2486542,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,3,10.49461680650711 3735,4855,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.20448492,ISDB,,,,,,,CJPAHDXHCYFKCY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8179396986961365 3736,4854,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.20789437,ISDB,OFOZQDMSBJOEHH-MRXNPFEDSA-N,"InChI=1S/C17H31NO/c1-4-6-7-8-9-10-11-12-13-14-17(19)18-15-16(3)5-2/h11-14,16H,4-10,15H2,1-3H3,(H,18,19)/t16-/m1/s1",CCCCCCCC=CC=CC(=O)NC[C@H](C)CC,C17H31NO,,265.240564612,OFOZQDMSBJOEHH,Fatty acids,Fatty amides,N-acyl amines,Echinacea angustifolia,618371.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Echinacea'],['Echinacea angustifolia'],4,0,4.831577479839325 3737,4853,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton1ammonium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 3738,4853,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton1ammonium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 3739,4853,-1,,,,0.0,MS1_match,GMYLPJSOUAYAGD-UHFFFAOYSA-N,"InChI=1S/C29H32O16/c1-10-19(33)22(36)24(38)28(41-10)42-14-7-15(32)18-16(8-14)43-26(12-3-5-13(31)6-4-12)27(21(18)35)45-29-25(39)23(37)20(34)17(44-29)9-40-11(2)30/h3-8,10,17,19-20,22-25,28-29,31-34,36-39H,9H2,1-2H3",CC(=O)OCC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(OC4OC(C)C(O)C(O)C4O)cc(O)c3c2=O)C(O)C(O)C1O,C29H32O16,pos_2_1proton1sodium,636.169034944,GMYLPJSOUAYAGD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,0,6.0 3740,4853,-1,,,,0.0,MS1_match,RVQHAYGFBOZFPZ-LSHVOLAESA-N,"InChI=1S/C29H32O16/c1-11(31)40-10-20-23(35)25(37)27(39)29(45-20)42-14-6-15(32)21-16(33)8-17(43-18(21)7-14)12-2-4-13(5-3-12)41-28-26(38)24(36)22(34)19(9-30)44-28/h2-8,19-20,22-30,32,34-39H,9-10H2,1H3/t19-,20-,22-,23-,24-,25-,26-,27-,28-,29-/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]5O)cc4)oc3c2)[C@H](O)[C@H](O)[C@@H]1O,C29H32O16,pos_2_1proton1sodium,636.169034944,RVQHAYGFBOZFPZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum squarrosum,451574.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum squarrosum'],6,0,6.0 3741,4853,-1,,,,0.0,MS1_match,RVQHAYGFBOZFPZ-LSHVOLAESA-N,"InChI=1S/C29H32O16/c1-11(31)40-10-20-23(35)25(37)27(39)29(45-20)42-14-6-15(32)21-16(33)8-17(43-18(21)7-14)12-2-4-13(5-3-12)41-28-26(38)24(36)22(34)19(9-30)44-28/h2-8,19-20,22-30,32,34-39H,9-10H2,1H3/t19-,20-,22-,23-,24-,25-,26-,27-,28-,29-/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]5O)cc4)oc3c2)[C@H](O)[C@H](O)[C@@H]1O,C29H32O16,pos_2_1proton1sodium,636.169034944,RVQHAYGFBOZFPZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 3742,4853,-1,,,,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_2_2sodium,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 3743,4853,-1,,,,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_2_2sodium,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 3744,4852,-1,,,,0.0,MS1_match,ULSUXBXHSYSGDT-UHFFFAOYSA-N,"InChI=1S/C20H20O7/c1-22-12-8-6-11(7-9-12)14-10-13(21)15-16(23-2)18(24-3)20(26-5)19(25-4)17(15)27-14/h6-10H,1-5H3",COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1,C20H20O7,pos_2_1proton1potassium,372.1209029799999,ULSUXBXHSYSGDT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 3745,4850,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.262165,ISDB,KEOITPILCOILGM-ATMJNGMXSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23+,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,10.548660039901733 3746,4850,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.262165,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tangutica,21285.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tangutica'],8,3,10.548660039901733 3747,4850,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.262165,ISDB,KEOITPILCOILGM-LLJOFIFVSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C41H66O12,,750.4554275520003,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis orientalis,594147.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis orientalis'],8,3,10.548660039901733 3748,4850,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.262165,ISDB,KEOITPILCOILGM-FCWYPSSHSA-N,"InChI=1S/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24+,25+,26+,27-,28-,29+,30-,31+,32-,33-,34+,37-,38-,39+,40+,41-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C41H66O12,,750.455427552,KEOITPILCOILGM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,3,10.548660039901733 3749,4849,-1,,,,0.0,MS1_match,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,pos_1_1proton1methanol,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3750,4849,-1,,,,0.0,MS1_match,UYGYXBOUYJLANA-CCXSFMJYSA-N,"InChI=1S/C11H14O3/c1-6-4-7(12)5-8-9(13)2-3-10(14)11(6)8/h2-3,5-7,10-12,14H,4H2,1H3/t6-,7-,10-,11+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C=C[C@@H](O)[C@H]21,C11H14O3,pos_1_1proton1methanol,194.094294308,UYGYXBOUYJLANA,Terpenoids,,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3751,4847,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,AOYZHYGKLZTHEZ-GUQFWLGESA-N,"InChI=1S/C59H96O28/c1-23-33(64)37(68)42(73)50(80-23)85-46-28(19-61)82-48(45(76)40(46)71)78-20-29-35(66)39(70)44(75)52(84-29)87-53(77)59-14-12-54(2,3)16-25(59)24-8-9-32-55(4)17-26(63)47(56(5,22-62)31(55)10-11-58(32,7)57(24,6)13-15-59)86-49-41(72)36(67)30(21-79-49)83-51-43(74)38(69)34(65)27(18-60)81-51/h8,23,25-52,60-76H,9-22H2,1-7H3/t23-,25-,26+,27+,28+,29+,30-,31+,32+,33-,34+,35+,36-,37+,38-,39-,40+,41+,42+,43+,44+,45+,46+,47-,48+,49-,50-,51-,52-,55-,56-,57+,58+,59-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)C[C@@H](O)[C@H](O[C@@H]8OC[C@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C59H96O28,pos_3_1proton2sodium,1252.608812432,AOYZHYGKLZTHEZ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 3752,4846,1657,Terpenoids,Apocarotenoids,Megastigmanes,0.30486515,ISDB,FFYPJOJFUJFYAT-CFURNJPISA-N,"InChI=1S/C24H38O11/c1-11-7-13(25)8-24(3,4)14(11)6-5-12(2)34-23-21(31)19(29)18(28)16(35-23)10-33-22-20(30)17(27)15(26)9-32-22/h5-7,12,14-23,26-31H,8-10H2,1-4H3/b6-5+/t12?,14?,15-,16+,17-,18+,19-,20+,21+,22-,23+/m0/s1",CC1=CC(=O)CC(C)(C)C1/C=C/C(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O11,,502.241412036,FFYPJOJFUJFYAT,Terpenoids,Apocarotenoids,Megastigmanes,Gentiana straminea,615933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Gentiana'],['Gentiana straminea'],4,3,6.719460606575012 3753,4846,1657,Terpenoids,Apocarotenoids,Megastigmanes,0.30486515,ISDB,FFYPJOJFUJFYAT-AWZIMYOFSA-N,"InChI=1S/C24H38O11/c1-11-7-13(25)8-24(3,4)14(11)6-5-12(2)34-23-21(31)19(29)18(28)16(35-23)10-33-22-20(30)17(27)15(26)9-32-22/h5-7,12,14-23,26-31H,8-10H2,1-4H3/b6-5+/t12-,14+,15-,16-,17+,18-,19+,20-,21-,22+,23-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O11,,502.241412036,FFYPJOJFUJFYAT,Terpenoids,Apocarotenoids,Megastigmanes,Eriobotrya japonica,207983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Eriobotrya'],['Eriobotrya japonica'],4,3,6.719460606575012 3754,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-LEYMWFIESA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28?/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)C13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@@H]34,C28H45NO6,pos_1_1proton1isopropanol,491.32468816,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,0,6.0 3755,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-LEYMWFIESA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28?/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)C13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@@H]34,C28H45NO6,pos_1_1proton1isopropanol,491.32468816,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 3756,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-GQIRAUAMSA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28-/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)[C@@]13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@H]43,C28H45NO6,pos_1_1proton1isopropanol,491.3246881599999,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 3757,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-GQIRAUAMSA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28-/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)[C@@]13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@H]43,C28H45NO6,pos_1_1proton1isopropanol,491.3246881599999,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum macrorhynchum,7591226.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum macrorhynchum'],6,0,6.0 3758,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-LEYMWFIESA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28?/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)C13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@@H]34,C28H45NO6,pos_1_1proton1isopropanol,491.32468816,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Gymnaconitum gymnandrum,511673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Gymnaconitum'],['Gymnaconitum gymnandrum'],6,0,6.0 3759,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-LEYMWFIESA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28?/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)C13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@@H]34,C28H45NO6,pos_1_1proton1isopropanol,491.32468816,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 3760,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-GQIRAUAMSA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28-/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)[C@@]13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@H]43,C28H45NO6,pos_1_1proton1isopropanol,491.3246881599999,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 3761,4838,-1,,,,0.0,MS1_match,MBNBAHNWJUHSQR-GQIRAUAMSA-N,"InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3/t17-,18-,19+,20+,21-,22+,23-,24+,25-,26+,27+,28-/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(C)=O)[C@@]13[C@@H](OC)CC[C@@]4(COC)CN(CC)[C@@H]1[C@@H]2C[C@H]43,C28H45NO6,pos_1_1proton1isopropanol,491.3246881599999,MBNBAHNWJUHSQR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum macrorhynchum,7591226.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum macrorhynchum'],6,0,6.0 3762,4837,1142,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,PUJPMGBYYYNBII-OGVVJMRYSA-N,"InChI=1S/C24H39NO4/c1-6-25-12-22(2)8-7-18(28-4)24-14-9-13-16(27-3)11-23(29-5,19(14)20(13)26)15(21(24)25)10-17(22)24/h13-21,26H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO4,pos_2_2proton1ammonium,405.2879087279999,PUJPMGBYYYNBII,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,3,7.5 3763,4834,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,ODBRNZZJSYPIDI-VJXVFPJBSA-N,"InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O11,pos_1_sodium,448.10056145999977,ODBRNZZJSYPIDI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,2,9.0 3764,4834,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,ODBRNZZJSYPIDI-VJXVFPJBSA-N,"InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O11,pos_1_sodium,448.10056145999977,ODBRNZZJSYPIDI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,2,9.0 3765,4834,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,JPUKWEQWGBDDQB-QSOFNFLRSA-N,"InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C21H20O11,pos_1_sodium,448.10056146,JPUKWEQWGBDDQB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,2,9.0 3766,4834,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,JPUKWEQWGBDDQB-QSOFNFLRSA-N,"InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C21H20O11,pos_1_sodium,448.10056146,JPUKWEQWGBDDQB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,2,9.0 3767,4834,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,JPUKWEQWGBDDQB-QSOFNFLRSA-N,"InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C21H20O11,pos_1_sodium,448.10056146,JPUKWEQWGBDDQB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,2,9.0 3768,4827,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.30312255,ISDB,,,,,,,JETWTJJKCQERGG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.212490200996399 3769,4825,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.0,MS1_match,VWDLOXMZIGUBKM-AUGXRQBFSA-N,"InChI=1S/C35H58O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h8-10,20-22,24-33,36-39H,7,11-19H2,1-6H3/b9-8+/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H58O6,pos_2_2sodium,574.423339576,VWDLOXMZIGUBKM,Terpenoids,Steroids,Stigmastane steroids,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,0,7.0 3770,4825,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.0,MS1_match,VWDLOXMZIGUBKM-AUGXRQBFSA-N,"InChI=1S/C35H58O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h8-10,20-22,24-33,36-39H,7,11-19H2,1-6H3/b9-8+/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H58O6,pos_2_2sodium,574.423339576,VWDLOXMZIGUBKM,Terpenoids,Steroids,Stigmastane steroids,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,0,7.0 3771,4822,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.0,MS1_match,KQFJWNFKSIQXPX-PYJJOTKASA-N,"InChI=1S/C22H35NO7/c1-4-23-9-19(26)6-5-13(24)21-11-7-10-12(29-2)8-20(27,14(11)15(10)25)22(28,18(21)23)17(30-3)16(19)21/h10-18,24-28H,4-9H2,1-3H3/t10-,11-,12+,13+,14-,15+,16-,17+,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@]2(O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C22H35NO7,pos_1_1proton1methanol,425.24135246,KQFJWNFKSIQXPX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium scabriflorum,6131796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium scabriflorum'],6,3,7.5 3772,4822,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.0,MS1_match,KQFJWNFKSIQXPX-JBVFEIDLSA-N,"InChI=1S/C22H35NO7/c1-4-23-9-19(26)6-5-13(24)21-11-7-10-12(29-2)8-20(27,14(11)15(10)25)22(28,18(21)23)17(30-3)16(19)21/h10-18,24-28H,4-9H2,1-3H3/t10-,11-,12+,13+,14-,15-,16-,17+,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@]2(O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C22H35NO7,pos_1_1proton1methanol,425.24135246,KQFJWNFKSIQXPX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium potaninii var. bonvalotii,274603.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bonvalotii'],6,3,7.5 3773,4818,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.0,MS1_match,OLGZCXJLBHNVSV-DDQVRILVSA-N,"InChI=1S/C32H47NO8/c1-7-33-15-29(16-37-2)20(34)13-21(39-4)32-18-14-30(35)11-12-31(36,24(28(32)33)26(41-6)27(29)32)23(18)22(30)17-9-8-10-19(38-3)25(17)40-5/h8-10,18,20-24,26-28,34-36H,7,11-16H2,1-6H3/t18-,20-,21+,22-,23-,24+,26+,27-,28-,29+,30-,31-,32+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)CC[C@@](O)([C@H]5[C@H]6c5cccc(OC)c5OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C32H47NO8,pos_2_2proton1ammonium,573.3301674639998,OLGZCXJLBHNVSV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 3774,4818,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.0,MS1_match,OLGZCXJLBHNVSV-DDQVRILVSA-N,"InChI=1S/C32H47NO8/c1-7-33-15-29(16-37-2)20(34)13-21(39-4)32-18-14-30(35)11-12-31(36,24(28(32)33)26(41-6)27(29)32)23(18)22(30)17-9-8-10-19(38-3)25(17)40-5/h8-10,18,20-24,26-28,34-36H,7,11-16H2,1-6H3/t18-,20-,21+,22-,23-,24+,26+,27-,28-,29+,30-,31-,32+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)CC[C@@](O)([C@H]5[C@H]6c5cccc(OC)c5OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C32H47NO8,pos_2_2proton1ammonium,573.3301674639998,OLGZCXJLBHNVSV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,3,7.5 3775,4815,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.23289469,ISDB,,,,,,,GOOOCIIXFLVRAG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9315787553787231 3776,4813,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.2586921,ISDB,,,,,,,JSKFFGMODSNXFS,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0347683429718018 3777,4812,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.20965359,ISDB,CCWBQLZOTVKFAJ-USNSYDTGSA-N,"InChI=1S/C17H29NO3/c1-13(8-4-3-7-11-19)12-14-16(20)17(2,21)15-9-5-6-10-18(14)15/h3-4,8,14-16,19-21H,5-7,9-12H2,1-2H3/b4-3+,13-8+/t14-,15+,16-,17-/m0/s1",C/C(=C\C=C\CCO)C[C@H]1[C@H](O)[C@@](C)(O)[C@H]2CCCCN12,C17H29NO3,,295.214743788,CCWBQLZOTVKFAJ,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,2,1.8386143445968628 3778,4812,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.20965359,ISDB,CCWBQLZOTVKFAJ-UHFFFAOYSA-N,"InChI=1S/C17H29NO3/c1-13(8-4-3-7-11-19)12-14-16(20)17(2,21)15-9-5-6-10-18(14)15/h3-4,8,14-16,19-21H,5-7,9-12H2,1-2H3",CC(=CC=CCCO)CC1C(O)C(C)(O)C2CCCCN12,C17H29NO3,,295.214743788,CCWBQLZOTVKFAJ,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Streptomyces albidoflavus,772836.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Streptomyces albidoflavus'],0,2,1.8386143445968628 3779,4810,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3780,4810,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3781,4808,-1,,,,0.0,MS1_match,DYFUVQSGLMQLRX-ALBXZGMBSA-N,"InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O10,pos_2_2proton,648.387347992,DYFUVQSGLMQLRX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,0,7.0 3782,4808,-1,,,,0.0,MS1_match,DYFUVQSGLMQLRX-ALBXZGMBSA-N,"InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O10,pos_2_2proton,648.387347992,DYFUVQSGLMQLRX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,0,7.0 3783,4807,312,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.8459678,ISDB,UPNWOCRDANTCBA-DUXPYHPUSA-N,"InChI=1S/C19H21NO4/c1-24-18-13-15(7-10-17(18)22)3-2-4-19(23)20-12-11-14-5-8-16(21)9-6-14/h2,4-10,13,21-22H,3,11-12H2,1H3,(H,20,23)/b4-2+",COc1cc(C/C=C/C(=O)NCCc2ccc(O)cc2)ccc1O,C19H21NO4,,327.147058152,UPNWOCRDANTCBA,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Pisonia aculeata,833114.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Nyctaginaceae'],['Unknown'],['Pisonia'],['Pisonia aculeata'],0,3,4.88387131690979 3784,4806,-1,,,,0.27699056,ISDB,JPUYZYRCOVZLPY-UHFFFAOYSA-N,"InChI=1S/C14H16/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,5,8,10,12,14H,4,6H2,1-2H3",CC=CC#CC#CC=CC=CCCC,C14H16,,184.125200512,JPUYZYRCOVZLPY,Fatty acids,Fatty acyls,Hydrocarbons,Clibadium armanii,7604909.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Clibadium'],['Clibadium armanii'],4,0,5.107962250709534 3785,4805,-1,,,,0.0,MS1_match,MNTSOBLYWJLVEK-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-25(39-27(29)10-16)14-1-4-18(5-2-14)38-24-6-3-15(7-19(24)33)26-13-23(37)30-21(35)9-17(32)11-28(30)40-26/h1-13,31-35H",O=c1cc(-c2ccc(Oc3ccc(-c4cc(=O)c5c(O)cc(O)cc5o4)cc3O)cc2)oc2cc(O)cc(O)c12,C30H18O10,pos_2MH,538.089996776,MNTSOBLYWJLVEK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3786,4805,-1,,,,0.0,MS1_match,NNPGECDACGBKDH-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-13,31-35H",O=c1cc(-c2ccc(Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O)cc2)oc2cc(O)cc(O)c12,C30H18O10,pos_2MH,538.0899967759999,NNPGECDACGBKDH,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3787,4796,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.6297727,ISDB,VRYRMXWYCOQDIY-FHXSIZRNSA-N,"InChI=1S/C48H78O17/c1-21-30(52)33(55)36(58)39(60-21)64-38-35(57)32(54)23(19-49)62-41(38)65-37-34(56)31(53)22(2)61-40(37)63-29-12-13-44(7)24(43(29,5)6)10-14-45(8)25(44)11-15-48-26-16-42(3,4)27(50)18-47(26,20-59-48)28(51)17-46(45,48)9/h11,15,21-41,49-58H,10,12-14,16-20H2,1-9H3/t21-,22+,23+,24-,25+,26+,27+,28+,29-,30-,31-,32+,33+,34-,35-,36+,37+,38+,39-,40-,41-,44-,45+,46-,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O[C@H]4CC[C@]5(C)[C@H]6C=C[C@]78OC[C@@]9(C[C@@H](O)C(C)(C)C[C@H]97)[C@H](O)C[C@@]8(C)[C@]6(C)CC[C@H]5C4(C)C)O[C@H](C)[C@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C48H78O17,,926.523901036,VRYRMXWYCOQDIY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Bupleurum rotundifolium,184703.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum rotundifolium'],4,2,7.519090890884399 3788,4794,-1,,,,0.0,MS1_match,LIJXXJLANJDJHH-RISOHXOYSA-N,"InChI=1S/C20H26O3/c1-11(2)15-9-17(22)18-14(19(15)23)5-6-16-12(3)13(10-21)7-8-20(16,18)4/h9,11,13,16,21H,3,5-8,10H2,1-2,4H3/t13-,16-,20-/m0/s1",C=C1[C@H](CO)CC[C@]2(C)C3=C(CC[C@@H]12)C(=O)C(C(C)C)=CC3=O,C20H26O3,pos_1_sodium,314.188194692,LIJXXJLANJDJHH,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3789,4794,-1,,,,0.0,MS1_match,ZSUIKYWXQBBQHV-UHFFFAOYSA-N,"InChI=1S/C60H78O9/c1-34-45-37(54(7)24-28-58(11)43-33-52(5,48(64)67-14)20-18-50(43,3)22-26-56(58,9)41(54)31-38(45)61)29-39-46(34)69-59(12)35-15-16-40-53(6,36(35)30-44(62)60(59,65)68-39)23-27-57(10)42-32-51(4,47(63)66-13)19-17-49(42,2)21-25-55(40,57)8/h15-16,29-31,42-43,65H,17-28,32-33H2,1-14H3",COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(=CC(=O)C6(O)Oc7cc8c(c(C)c7OC56C)C(=O)C=C5C8(C)CCC6(C)C7CC(C)(C(=O)OC)CCC7(C)CCC56C)C4(C)CCC3(C)C2C1,C60H78O9,pos_3_3sodium,942.564584076,ZSUIKYWXQBBQHV,Terpenoids,Triterpenoids,Friedelane triterpenoids,Hippocratea volubilis,232493.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Hippocratea'],['Hippocratea volubilis'],6,0,6.0 3790,4794,-1,,,,0.0,MS1_match,FSCQPKNDXDBVDG-KDTKLNGCSA-N,"InChI=1S/C60H78O9/c1-34-45-37(54(7)24-28-58(11)43-33-52(5,48(64)67-14)20-18-50(43,3)22-26-56(58,9)41(54)31-38(45)61)29-39-46(34)69-60(65)44(62)30-36-35(59(60,12)68-39)15-16-40-53(36,6)23-27-57(10)42-32-51(4,47(63)66-13)19-17-49(42,2)21-25-55(40,57)8/h15-16,29-31,42-43,65H,17-28,32-33H2,1-14H3/t42-,43+,49-,50-,51-,52-,53+,54+,55-,56-,57+,58+,59+,60-/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)[C@@]6(O)Oc7c(cc8c(c7C)C(=O)C=C7[C@@]8(C)CC[C@@]8(C)[C@H]9C[C@](C)(C(=O)OC)CC[C@]9(C)CC[C@]78C)O[C@@]56C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C60H78O9,pos_3_3sodium,942.564584076,FSCQPKNDXDBVDG,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus spinosa,995600.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia spinosa'],6,0,6.0 3791,4794,-1,,,,0.0,MS1_match,FSCQPKNDXDBVDG-KDTKLNGCSA-N,"InChI=1S/C60H78O9/c1-34-45-37(54(7)24-28-58(11)43-33-52(5,48(64)67-14)20-18-50(43,3)22-26-56(58,9)41(54)31-38(45)61)29-39-46(34)69-60(65)44(62)30-36-35(59(60,12)68-39)15-16-40-53(36,6)23-27-57(10)42-32-51(4,47(63)66-13)19-17-49(42,2)21-25-55(40,57)8/h15-16,29-31,42-43,65H,17-28,32-33H2,1-14H3/t42-,43+,49-,50-,51-,52-,53+,54+,55-,56-,57+,58+,59+,60-/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)[C@@]6(O)Oc7c(cc8c(c7C)C(=O)C=C7[C@@]8(C)CC[C@@]8(C)[C@H]9C[C@](C)(C(=O)OC)CC[C@]9(C)CC[C@]78C)O[C@@]56C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C60H78O9,pos_3_3sodium,942.564584076,FSCQPKNDXDBVDG,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus scutioides,6093023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus scutioides'],6,0,6.0 3792,4794,-1,,,,0.0,MS1_match,FSCQPKNDXDBVDG-KDTKLNGCSA-N,"InChI=1S/C60H78O9/c1-34-45-37(54(7)24-28-58(11)43-33-52(5,48(64)67-14)20-18-50(43,3)22-26-56(58,9)41(54)31-38(45)61)29-39-46(34)69-60(65)44(62)30-36-35(59(60,12)68-39)15-16-40-53(36,6)23-27-57(10)42-32-51(4,47(63)66-13)19-17-49(42,2)21-25-55(40,57)8/h15-16,29-31,42-43,65H,17-28,32-33H2,1-14H3/t42-,43+,49-,50-,51-,52-,53+,54+,55-,56-,57+,58+,59+,60-/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)[C@@]6(O)Oc7c(cc8c(c7C)C(=O)C=C7[C@@]8(C)CC[C@@]8(C)[C@H]9C[C@](C)(C(=O)OC)CC[C@]9(C)CC[C@]78C)O[C@@]56C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C60H78O9,pos_3_3sodium,942.564584076,FSCQPKNDXDBVDG,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia spinosa,995600.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia spinosa'],6,0,6.0 3793,4794,-1,,,,0.0,MS1_match,VPAOFTLPVCAESA-MDHJQYLISA-N,"InChI=1S/C20H26O3/c1-11-13-10-12-6-7-14-19(2,3)8-5-9-20(14,4)15(12)16(21)17(13)23-18(11)22/h10-11,14,21H,5-9H2,1-4H3/t11?,14-,20-/m0/s1",CC1C(=O)Oc2c1cc1c(c2O)[C@@]2(C)CCCC(C)(C)[C@@H]2CC1,C20H26O3,pos_1_sodium,314.188194692,VPAOFTLPVCAESA,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Crossopetalum gaumeri,1091453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Crossopetalum'],['Crossopetalum gaumeri'],6,0,6.0 3794,4794,-1,,,,0.0,MS1_match,DYYRDAOHGZJZRW-HNNXBMFYSA-N,"InChI=1S/C20H26O3/c1-11(2)14-10-13-7-6-12(3)16-15(21)8-9-20(4,5)23-19(17(13)16)18(14)22/h6-7,10-11,15,21-22H,8-9H2,1-5H3/t15-/m0/s1",Cc1ccc2cc(C(C)C)c(O)c3c2c1[C@@H](O)CCC(C)(C)O3,C20H26O3,pos_1_sodium,314.188194692,DYYRDAOHGZJZRW,Terpenoids,Diterpenoids,Secoabietane diterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3795,4794,-1,,,,0.0,MS1_match,DYYRDAOHGZJZRW-HNNXBMFYSA-N,"InChI=1S/C20H26O3/c1-11(2)14-10-13-7-6-12(3)16-15(21)8-9-20(4,5)23-19(17(13)16)18(14)22/h6-7,10-11,15,21-22H,8-9H2,1-5H3/t15-/m0/s1",Cc1ccc2cc(C(C)C)c(O)c3c2c1[C@@H](O)CCC(C)(C)O3,C20H26O3,pos_1_sodium,314.188194692,DYYRDAOHGZJZRW,Terpenoids,Diterpenoids,Secoabietane diterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3796,4794,-1,,,,0.0,MS1_match,JMZHTRDGDKQYEC-DBVUQKKJSA-N,"InChI=1S/C20H26O3/c1-12(2)14-10-15(22)17-13(18(14)23)6-7-16-19(3,11-21)8-5-9-20(16,17)4/h10-12,16H,5-9H2,1-4H3/t16-,19+,20-/m0/s1",CC(C)C1=CC(=O)C2=C(CC[C@H]3[C@@](C)(C=O)CCC[C@]23C)C1=O,C20H26O3,pos_1_sodium,314.188194692,JMZHTRDGDKQYEC,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3797,4794,-1,,,,0.0,MS1_match,ZSGWCLHXXPJIDF-JXFKEZNVSA-N,"InChI=1S/C20H26O3/c1-11(2)15-9-17(22)18-14(19(15)23)5-6-16-12(3)13(10-21)7-8-20(16,18)4/h9,11,16,21H,5-8,10H2,1-4H3/t16-,20-/m0/s1",CC1=C(CO)CC[C@]2(C)C3=C(CC[C@@H]12)C(=O)C(C(C)C)=CC3=O,C20H26O3,pos_1_sodium,314.188194692,ZSGWCLHXXPJIDF,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 3798,4794,-1,,,,0.0,MS1_match,ZSGWCLHXXPJIDF-JXFKEZNVSA-N,"InChI=1S/C20H26O3/c1-11(2)15-9-17(22)18-14(19(15)23)5-6-16-12(3)13(10-21)7-8-20(16,18)4/h9,11,16,21H,5-8,10H2,1-4H3/t16-,20-/m0/s1",CC1=C(CO)CC[C@]2(C)C3=C(CC[C@@H]12)C(=O)C(C(C)C)=CC3=O,C20H26O3,pos_1_sodium,314.188194692,ZSGWCLHXXPJIDF,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3799,4794,-1,,,,0.0,MS1_match,LIJXXJLANJDJHH-RISOHXOYSA-N,"InChI=1S/C20H26O3/c1-11(2)15-9-17(22)18-14(19(15)23)5-6-16-12(3)13(10-21)7-8-20(16,18)4/h9,11,13,16,21H,3,5-8,10H2,1-2,4H3/t13-,16-,20-/m0/s1",C=C1[C@H](CO)CC[C@]2(C)C3=C(CC[C@@H]12)C(=O)C(C(C)C)=CC3=O,C20H26O3,pos_1_sodium,314.188194692,LIJXXJLANJDJHH,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 3800,4794,-1,,,,0.0,MS1_match,ZSUIKYWXQBBQHV-UHFFFAOYSA-N,"InChI=1S/C60H78O9/c1-34-45-37(54(7)24-28-58(11)43-33-52(5,48(64)67-14)20-18-50(43,3)22-26-56(58,9)41(54)31-38(45)61)29-39-46(34)69-59(12)35-15-16-40-53(6,36(35)30-44(62)60(59,65)68-39)23-27-57(10)42-32-51(4,47(63)66-13)19-17-49(42,2)21-25-55(40,57)8/h15-16,29-31,42-43,65H,17-28,32-33H2,1-14H3",COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(=CC(=O)C6(O)Oc7cc8c(c(C)c7OC56C)C(=O)C=C5C8(C)CCC6(C)C7CC(C)(C(=O)OC)CCC7(C)CCC56C)C4(C)CCC3(C)C2C1,C60H78O9,pos_3_3sodium,942.564584076,ZSUIKYWXQBBQHV,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus woodsonii,433240.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus woodsonii'],6,0,6.0 3801,4794,-1,,,,0.0,MS1_match,HNCVSYIVZNESJY-YSSFQJQWSA-N,"InChI=1S/C20H26O3/c1-11(2)14-10-16(21)17-13(18(14)22)6-7-15-12(3)20(5,23)9-8-19(15,17)4/h10-11,15,23H,3,6-9H2,1-2,4-5H3/t15-,19-,20-/m0/s1",C=C1[C@@H]2CCC3=C(C(=O)C=C(C(C)C)C3=O)[C@@]2(C)CC[C@]1(C)O,C20H26O3,pos_1_sodium,314.188194692,HNCVSYIVZNESJY,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 3802,4794,-1,,,,0.0,MS1_match,HNCVSYIVZNESJY-YSSFQJQWSA-N,"InChI=1S/C20H26O3/c1-11(2)14-10-16(21)17-13(18(14)22)6-7-15-12(3)20(5,23)9-8-19(15,17)4/h10-11,15,23H,3,6-9H2,1-2,4-5H3/t15-,19-,20-/m0/s1",C=C1[C@@H]2CCC3=C(C(=O)C=C(C(C)C)C3=O)[C@@]2(C)CC[C@]1(C)O,C20H26O3,pos_1_sodium,314.188194692,HNCVSYIVZNESJY,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3803,4794,-1,,,,0.0,MS1_match,QMDCLEYBHPVIBC-FQEVSTJZSA-N,"InChI=1S/C20H26O3/c1-11(2)14-10-17(22)18-13(19(14)23-5)6-7-15-12(3)16(21)8-9-20(15,18)4/h10-11,22H,6-9H2,1-5H3/t20-/m0/s1",COc1c(C(C)C)cc(O)c2c1CCC1=C(C)C(=O)CC[C@@]12C,C20H26O3,pos_1_sodium,314.188194692,QMDCLEYBHPVIBC,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3804,4794,-1,,,,0.0,MS1_match,AILBGNUDAQUSML-MISYRCLQSA-N,"InChI=1S/C20H26O3/c1-12(2)13-5-6-15-14(9-13)16(22)10-17-19(15,3)8-7-18(23)20(17,4)11-21/h5-6,9,12,17,21H,7-8,10-11H2,1-4H3/t17-,19-,20-/m1/s1",CC(C)c1ccc2c(c1)C(=O)C[C@H]1[C@@](C)(CO)C(=O)CC[C@]21C,C20H26O3,pos_1_sodium,314.188194692,AILBGNUDAQUSML,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3805,4794,-1,,,,0.0,MS1_match,FBHMVUCYIROVOC-UHFFFAOYSA-N,"InChI=1S/C20H26O3/c1-11(2)13-5-8-17-15(18(13)21)6-7-16-12(3)14(19(22)23)9-10-20(16,17)4/h5,8,11,16,21H,6-7,9-10H2,1-4H3,(H,22,23)",CC1=C(C(=O)O)CCC2(C)c3ccc(C(C)C)c(O)c3CCC12,C20H26O3,pos_1_sodium,314.188194692,FBHMVUCYIROVOC,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium doianum,293273.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium doianum'],6,0,6.0 3806,4794,-1,,,,0.0,MS1_match,FBHMVUCYIROVOC-JXFKEZNVSA-N,"InChI=1S/C20H26O3/c1-11(2)13-5-8-17-15(18(13)21)6-7-16-12(3)14(19(22)23)9-10-20(16,17)4/h5,8,11,16,21H,6-7,9-10H2,1-4H3,(H,22,23)/t16-,20-/m0/s1",CC1=C(C(=O)O)CC[C@]2(C)c3ccc(C(C)C)c(O)c3CC[C@@H]12,C20H26O3,pos_1_sodium,314.188194692,FBHMVUCYIROVOC,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3807,4794,-1,,,,0.0,MS1_match,JRDCNBZYYIEMRB-YWZLYKJASA-N,"InChI=1S/C20H26O3/c1-11(2)13-10-14(21)17-12(18(13)23)6-7-15-19(3,4)16(22)8-9-20(15,17)5/h10-11,15H,6-9H2,1-5H3/t15-,20-/m0/s1",CC(C)C1=CC(=O)C2=C(CC[C@H]3C(C)(C)C(=O)CC[C@]23C)C1=O,C20H26O3,pos_1_sodium,314.188194692,JRDCNBZYYIEMRB,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium doianum,293273.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium doianum'],6,0,6.0 3808,4794,-1,,,,0.0,MS1_match,JRDCNBZYYIEMRB-YWZLYKJASA-N,"InChI=1S/C20H26O3/c1-11(2)13-10-14(21)17-12(18(13)23)6-7-15-19(3,4)16(22)8-9-20(15,17)5/h10-11,15H,6-9H2,1-5H3/t15-,20-/m0/s1",CC(C)C1=CC(=O)C2=C(CC[C@H]3C(C)(C)C(=O)CC[C@]23C)C1=O,C20H26O3,pos_1_sodium,314.188194692,JRDCNBZYYIEMRB,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 3809,4794,-1,,,,0.0,MS1_match,JRDCNBZYYIEMRB-YWZLYKJASA-N,"InChI=1S/C20H26O3/c1-11(2)13-10-14(21)17-12(18(13)23)6-7-15-19(3,4)16(22)8-9-20(15,17)5/h10-11,15H,6-9H2,1-5H3/t15-,20-/m0/s1",CC(C)C1=CC(=O)C2=C(CC[C@H]3C(C)(C)C(=O)CC[C@]23C)C1=O,C20H26O3,pos_1_sodium,314.188194692,JRDCNBZYYIEMRB,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3810,4794,-1,,,,0.0,MS1_match,BYADCGKNIQXKLP-UHFFFAOYSA-N,"InChI=1S/C20H26O3/c1-12-15(18(21)22)9-10-20(4)16(12)7-5-13-11-14(19(2,3)23)6-8-17(13)20/h6,8,11,16,23H,5,7,9-10H2,1-4H3,(H,21,22)",CC1=C(C(=O)O)CCC2(C)c3ccc(C(C)(C)O)cc3CCC12,C20H26O3,pos_1_sodium,314.188194692,BYADCGKNIQXKLP,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3811,4794,-1,,,,0.0,MS1_match,ZSUIKYWXQBBQHV-HODKZATGSA-N,"InChI=1S/C60H78O9/c1-34-45-37(54(7)24-28-58(11)43-33-52(5,48(64)67-14)20-18-50(43,3)22-26-56(58,9)41(54)31-38(45)61)29-39-46(34)69-59(12)35-15-16-40-53(6,36(35)30-44(62)60(59,65)68-39)23-27-57(10)42-32-51(4,47(63)66-13)19-17-49(42,2)21-25-55(40,57)8/h15-16,29-31,42-43,65H,17-28,32-33H2,1-14H3/t42-,43-,49-,50-,51-,52-,53+,54+,55-,56-,57+,58+,59-,60+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)[C@]6(O)Oc7cc8c(c(C)c7O[C@]56C)C(=O)C=C5[C@@]8(C)CC[C@@]6(C)[C@@H]7C[C@](C)(C(=O)OC)CC[C@]7(C)CC[C@]56C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C60H78O9,pos_3_3sodium,942.564584076,ZSUIKYWXQBBQHV,Terpenoids,Triterpenoids,Friedelane triterpenoids,Semialarium mexicanum,857478.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Semialarium'],['Semialarium mexicanum'],6,0,6.0 3812,4790,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.20776014,ISDB,,,,,,,KJXUUBWLHCNIND,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8310405611991882 3813,4789,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3814,4789,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 3815,4789,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3816,4789,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 3817,4789,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,3,7.5 3818,4789,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 3819,4786,-1,,,,0.4602166,ISDB,WCXZTKJFWJFMJG-UHFFFAOYSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)",CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(CO)C5CCC43C)C2C1,C30H46O4,,470.339609952,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,0,8.840866446495056 3820,4786,-1,,,,0.4602166,ISDB,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,8.840866446495056 3821,4786,-1,,,,0.4602166,ISDB,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla dahurica,972663.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla dahurica'],7,0,8.840866446495056 3822,4783,-1,,,,0.6421519,ISDB,YRLBRLSLZIRTGX-MLQUENCRSA-N,"InChI=1S/C27H43NO2/c1-16-4-9-25-27(3,30)23-8-7-19-20-6-5-17-12-18(29)10-11-26(17,2)24(20)13-21(19)22(23)15-28(25)14-16/h5,16,18-25,29-30H,4,6-15H2,1-3H3/t16-,18+,19-,20-,21+,22-,23-,24-,25-,26-,27-/m0/s1",C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC=C5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O,C27H43NO2,,413.329379616,YRLBRLSLZIRTGX,Alkaloids,Pseudoalkaloids,Steroidal alkaloids,Fritillaria verticillata,3966611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Fritillaria'],['Fritillaria verticillata'],4,0,6.568607568740845 3823,4782,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.835617,ISDB,NKLJXRAXPUMTJG-UHFFFAOYSA-N,"InChI=1S/C21H21NO5/c1-22-6-5-12-17-14(22)7-11-8-15(23-2)16(24-3)9-13(11)18(17)20-21(19(12)25-4)27-10-26-20/h7-9H,5-6,10H2,1-4H3",COc1cc2cc3c4c(c(OC)c5c(c4c2cc1OC)OCO5)CCN3C,C21H21NO5,,367.141972772,NKLJXRAXPUMTJG,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum isopyroides,98291.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum isopyroides'],4,2,8.342468023300171 3824,4777,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SNWJEAGXJFVRPD-CZIWMOKQSA-N,"InChI=1S/C25H40O9/c1-14(2)7-20(27)31-11-17-12-32-24(34-22(29)9-16(5)6)23-18(17)10-19(26)25(23,30)13-33-21(28)8-15(3)4/h12,14-16,18-19,23-24,26,30H,7-11,13H2,1-6H3/t18-,19+,23-,24+,25-/m1/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1C[C@H](O)[C@]2(O)COC(=O)CC(C)C,C25H40O9,pos_1_sodium,484.26723286,SNWJEAGXJFVRPD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 3825,4771,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1potassium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3826,4771,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1potassium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3827,4771,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3828,4771,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3829,4771,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3830,4771,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3831,4771,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3832,4771,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3833,4769,-1,,,,0.233989,ISDB,,,,,,,IUGTZYDAVILZIT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9359560012817383 3834,4766,795,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,0.0,MS1_match,ATPPQNYORHPCJE-UHFFFAOYSA-N,"InChI=1S/C29H42O4/c1-16-7-11-28-14-13-27(6)26(5)10-8-19-18(3)22(31)20(30)15-25(19,4)21(26)9-12-29(27,33-24(28)32)23(28)17(16)2/h9,12,16-17,19-23,30-31H,3,7-8,10-11,13-15H2,1-2,4-6H3",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2C=CC23OC(=O)C4(CCC(C)C(C)C42)CCC13C,C29H42O4,pos_1_1proton1ammonium,454.308309824,ATPPQNYORHPCJE,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,3,7.5 3835,4766,795,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,0.0,MS1_match,ATPPQNYORHPCJE-UHFFFAOYSA-N,"InChI=1S/C29H42O4/c1-16-7-11-28-14-13-27(6)26(5)10-8-19-18(3)22(31)20(30)15-25(19,4)21(26)9-12-29(27,33-24(28)32)23(28)17(16)2/h9,12,16-17,19-23,30-31H,3,7-8,10-11,13-15H2,1-2,4-6H3",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2C=CC23OC(=O)C4(CCC(C)C(C)C42)CCC13C,C29H42O4,pos_1_1proton1ammonium,454.308309824,ATPPQNYORHPCJE,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,3,7.5 3836,4752,993,Terpenoids,Diterpenoids,Aromatic polyketides with side chains,0.5828165,ISDB,FHEJLVSXCHPHAN-FPLPWBNLSA-N,"InChI=1S/C24H36O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23(28)21(26)18(2)22(27)24(20)29-19(3)25/h7-8,26H,4-6,9-17H2,1-3H3/b8-7-",CCCC/C=C\CCCCCCCCCC1=C(OC(C)=O)C(=O)C(C)=C(O)C1=O,C24H36O5,,404.256274252,FHEJLVSXCHPHAN,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,Maesa lanceolata,607844.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Maesa'],['Maesa lanceolata'],4,3,7.831265926361084 3837,4751,97,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,JJUCBHSRJQINGH-YGUDKLPYSA-N,"InChI=1S/C14H24O4/c1-12(2)8-6-10(16)13(3)11(17)9(15)4-5-14(13,7-8)18-12/h8-11,15-17H,4-7H2,1-3H3/t8-,9+,10+,11+,13-,14-/m1/s1",CC1(C)O[C@@]23CC[C@H](O)[C@H](O)[C@@]2(C)[C@@H](O)C[C@@H]1C3,C14H24O4,pos_2MHCH3CN,256.167459248,JJUCBHSRJQINGH,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,3,7.5 3838,4748,967,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.22124879,ISDB,OHUGBIGEVDVYSF-OCCJYARASA-N,"InChI=1S/C29H46O3/c1-25(2)22-10-9-18-19(29(22,6)12-11-23(25)30)7-8-20-21-17-27(4,24(31)32)14-13-26(21,3)15-16-28(18,20)5/h8,18-19,21-23,30H,7,9-17H2,1-6H3,(H,31,32)/t18-,19+,21+,22+,23+,26-,27-,28+,29-/m1/s1",CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3CC=C4[C@@H]5C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@@]4(C)[C@@H]3CC[C@@H]12,C29H46O3,,442.344695332,OHUGBIGEVDVYSF,Terpenoids,Triterpenoids,Oleanane triterpenoids,Tripterygium doianum,293273.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium doianum'],6,3,8.38499516248703 3839,4744,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3840,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,0,7.0 3841,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,0,7.0 3842,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3843,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 3844,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3845,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3846,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3847,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,0,7.0 3848,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3849,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 3850,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3851,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3852,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3853,4744,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,0,7.0 3854,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 3855,4744,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3856,4744,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 3857,4744,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_sodium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 3858,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3859,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 3860,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 3861,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_sodium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3862,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 3863,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 3864,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_sodium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3865,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3866,4744,-1,,,,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_sodium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 3867,4738,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.9111642,ISDB,PHHDVGGCTAPBHF-UHFFFAOYSA-N,"InChI=1S/C15H20O3/c1-3-4-5-6-13(16)9-7-12-8-10-14(17)15(11-12)18-2/h5-6,8,10-11,17H,3-4,7,9H2,1-2H3",CCCC=CC(=O)CCc1ccc(O)c(OC)c1,C15H20O3,,248.1412445,PHHDVGGCTAPBHF,,,,Zingiber officinale,1063866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Zingiber'],['Zingiber officinale'],4,0,7.6446568965911865 3868,4735,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3869,4735,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3870,4735,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3871,4735,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3872,4732,-1,,,,0.4873019,ISDB,BBAXNNBTFRECAH-HNEHENEDSA-N,"InChI=1S/C27H45NO4/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25,32)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-25,29-31H,4-14H2,1-3H3/t15-,16-,17-,18+,19-,20-,21-,22-,23+,24-,25-,26+,27-,28-/m0/s1",C[C@H]1CC[C@H]2[C@@](C)(O)[C@H]3CC[C@H]4[C@@H](C[C@H]5[C@H]4C[C@H](O)[C@H]4C[C@@H](O)CC[C@@]45C)[C@@H]3C[N@@+]2([O-])C1,C27H45NO4,,447.33485892,BBAXNNBTFRECAH,Alkaloids,Pseudoalkaloids,Steroidal alkaloids,Fritillaria thunbergii,935709.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Fritillaria'],['Fritillaria thunbergii'],4,0,5.949207544326782 3873,4729,-1,,,,0.0,MS1_match,HMTVXYYWICMXMY-YSVDCJIHSA-N,"InChI=1S/C15H26O3/c1-8-5-11(16)13-9(8)6-10-12(17)7-15(13,4)18-14(10,2)3/h8-13,16-17H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O3,pos_1_1proton1methanol,254.188194692,HMTVXYYWICMXMY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3874,4729,-1,,,,0.0,MS1_match,HMTVXYYWICMXMY-YSVDCJIHSA-N,"InChI=1S/C15H26O3/c1-8-5-11(16)13-9(8)6-10-12(17)7-15(13,4)18-14(10,2)3/h8-13,16-17H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O3,pos_1_1proton1methanol,254.188194692,HMTVXYYWICMXMY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 3875,4729,-1,,,,0.0,MS1_match,QDZQKRSRABUOAX-OBRUSBNWSA-N,"InChI=1S/C15H26O3/c1-12(2)10-5-7-13(3)8-6-11(16)14(4,17)15(13,9-10)18-12/h10-11,16-17H,5-9H2,1-4H3/t10-,11+,13-,14-,15-/m1/s1",CC1(C)O[C@]23C[C@H]1CC[C@]2(C)CC[C@H](O)[C@@]3(C)O,C15H26O3,pos_1_1proton1methanol,254.188194692,QDZQKRSRABUOAX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus boaria,418513.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus boaria'],6,0,6.0 3876,4724,1832,Alkaloids,Pseudoalkaloids,Fatty acyl glycosides of mono- and disaccharides,0.0,MS1_match,UESBDVWPNXRGMG-CHUSNLCUSA-N,"InChI=1S/C26H35NO7/c1-11(2)21(30)34-14-7-23(5)10-27(32)15-9-24-6-12(3)16-17(29)19(24)25(8-14,18(15)23)22(27)26(24,31)20(16)33-13(4)28/h11,14-20,22,29,31H,3,6-10H2,1-2,4-5H3/t14-,15-,16+,17+,18+,19+,20+,22-,23+,24+,25-,26-,27-/m0/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@]6(C)C[C@H](OC(=O)C(C)C)C[C@@]57[C@@H]2[C@H](O)[C@@H]1[C@@H](OC(C)=O)[C@]3(O)[C@H]7[N@+]4([O-])C6,C26H35NO7,pos_1_1proton1ammonium,473.24135246,UESBDVWPNXRGMG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum coreanum,377294.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum coreanum'],6,2,7.0 3877,4724,1832,Alkaloids,Pseudoalkaloids,Fatty acyl glycosides of mono- and disaccharides,0.0,MS1_match,CADWDUBJVBYWFP-XHQSDXEWSA-N,"InChI=1S/C24H35NO7/c1-27-11-20-6-5-17(29-3)23-15-7-13-14(28-2)8-22(24(15,26)18(13)30-4)21(9-16(20)23,31-12-32-22)19(23)25-10-20/h10,13-19,26H,5-9,11-12H2,1-4H3/t13-,14+,15+,16-,17+,18+,19-,20+,21-,22+,23-,24+/m1/s1",COC[C@@]12C=N[C@H]3[C@@]4([C@@H](OC)CC1)[C@@H]2C[C@@]31OCO[C@@]12C[C@H](OC)[C@H]1C[C@@H]4[C@]2(O)[C@H]1OC,C24H35NO7,pos_1_1proton1acetonitrile,449.24135246,CADWDUBJVBYWFP,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium caeruleum,884038.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium caeruleum'],6,2,7.0 3878,4724,1832,Alkaloids,Pseudoalkaloids,Fatty acyl glycosides of mono- and disaccharides,0.0,MS1_match,BFMKQHHAHFUOFC-WCENVSJRSA-N,"InChI=1S/C24H35NO7/c1-5-25-10-21(11-30-2)7-6-15(26)23-13-8-12-14(31-3)9-22(28,16(13)17(12)27)24(29,20(23)25)19(32-4)18(21)23/h6-7,12-16,18-20,26,28-29H,5,8-11H2,1-4H3/t12-,13-,14+,15+,16-,18-,19+,20+,21+,22-,23+,24-/m1/s1",CCN1C[C@]2(COC)C=C[C@H](O)[C@@]34[C@@H]5C[C@H]6C(=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C24H35NO7,pos_1_1proton1acetonitrile,449.24135246,BFMKQHHAHFUOFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,2,7.0 3879,4724,1832,Alkaloids,Pseudoalkaloids,Fatty acyl glycosides of mono- and disaccharides,0.0,MS1_match,ILGAPGCSXYBIJK-KTNVHQDHSA-N,"InChI=1S/C24H35NO7/c1-5-25-10-21-15-7-13-19(25)23(15,17(27)8-18(21)32-21)16-6-12-14(29-3)9-22(13,31-11(2)26)24(16,28)20(12)30-4/h12-20,27-28H,5-10H2,1-4H3/t12-,13+,14+,15-,16+,17+,18+,19-,20+,21-,22+,23+,24+/m1/s1",CCN1C[C@]23O[C@H]2C[C@H](O)[C@@]24[C@@H]3C[C@@H]([C@@H]12)[C@@]1(OC(C)=O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2OC,C24H35NO7,pos_1_1proton1acetonitrile,449.24135246,ILGAPGCSXYBIJK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kirinense,5737821.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kirinense'],6,2,7.0 3880,4722,-1,,,,0.21107972,ISDB,,,,,,,PDYJABXOYRNPHH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8443188667297363 3881,4718,-1,,,,0.37427923,ISDB,NLBYRERHXBTBBR-RTBURBONSA-N,"InChI=1S/C19H36O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h3,18-19,21-22H,1,4-16H2,2H3/t18-,19-/m1/s1",C=CCCCCCCCCCCC[C@@H](O)C[C@@H](O)COC(C)=O,C19H36O4,,328.26135963199994,NLBYRERHXBTBBR,Fatty acids,Fatty acyls,Fatty alcohols,Persea americana,913249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Persea'],['Persea americana'],4,0,5.497116923332214 3882,4717,-1,,,,0.0,MS1_match,TYPSVDGIQAOBAD-DZGCQCFKSA-N,"InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1",C=C1CCC[C@]2(C)Cc3occ(C)c3C[C@@H]12,C15H20O,pos_2MH,216.15141526,TYPSVDGIQAOBAD,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 3883,4717,-1,,,,0.0,MS1_match,TYPSVDGIQAOBAD-DZGCQCFKSA-N,"InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1",C=C1CCC[C@]2(C)Cc3occ(C)c3C[C@@H]12,C15H20O,pos_2MH,216.15141526,TYPSVDGIQAOBAD,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 3884,4716,-1,,,,0.36489683,ISDB,KSIWZCYBCSQXTA-UHFFFAOYSA-N,"InChI=1S/C29H43NO5/c1-6-20(2)15-22(4)17-23(5)16-21(3)11-9-7-8-10-12-27(33)30-24(19-31)18-29(34)26(32)14-13-25-28(29)35-25/h7-15,20-21,23-25,28,31,34H,6,16-19H2,1-5H3,(H,30,33)",CCC(C)C=C(C)CC(C)CC(C)C=CC=CC=CC(=O)NC(CO)CC1(O)C(=O)C=CC2OC21,C29H43NO5,,485.314123476,KSIWZCYBCSQXTA,Polyketides,Linear polyketides,Open-chain polyketides,Belonidium mollissimum,4044573.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Leotiomycetes'],['Helotiales'],['Lachnaceae'],['Unknown'],['Lachnum'],['Belonidium mollissimum'],1,0,2.459587335586548 3885,4716,-1,,,,0.36489683,ISDB,KSIWZCYBCSQXTA-JPOQAJQISA-N,"InChI=1S/C29H43NO5/c1-6-20(2)15-22(4)17-23(5)16-21(3)11-9-7-8-10-12-27(33)30-24(19-31)18-29(34)26(32)14-13-25-28(29)35-25/h7-15,20-21,23-25,28,31,34H,6,16-19H2,1-5H3,(H,30,33)/b8-7+,11-9+,12-10+,22-15+/t20-,21+,23+,24+,25+,28+,29-/m1/s1",CC[C@@H](C)/C=C(\C)C[C@@H](C)C[C@@H](C)/C=C/C=C/C=C/C(=O)N[C@H](CO)C[C@@]1(O)C(=O)C=C[C@@H]2O[C@@H]21,C29H43NO5,,485.314123476,KSIWZCYBCSQXTA,Polyketides,Linear polyketides,Open-chain polyketides,Lachnum mollissimum,4044573.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Leotiomycetes'],['Helotiales'],['Lachnaceae'],['Unknown'],['Lachnum'],['Belonidium mollissimum'],1,0,2.459587335586548 3886,4716,-1,,,,0.36489683,ISDB,KSIWZCYBCSQXTA-JPOQAJQISA-N,"InChI=1S/C29H43NO5/c1-6-20(2)15-22(4)17-23(5)16-21(3)11-9-7-8-10-12-27(33)30-24(19-31)18-29(34)26(32)14-13-25-28(29)35-25/h7-15,20-21,23-25,28,31,34H,6,16-19H2,1-5H3,(H,30,33)/b8-7+,11-9+,12-10+,22-15+/t20-,21+,23+,24+,25+,28+,29-/m1/s1",CC[C@@H](C)/C=C(\C)C[C@@H](C)C[C@@H](C)/C=C/C=C/C=C/C(=O)N[C@H](CO)C[C@@]1(O)C(=O)C=C[C@@H]2O[C@@H]21,C29H43NO5,,485.314123476,KSIWZCYBCSQXTA,Polyketides,Linear polyketides,Open-chain polyketides,Trichopeziza mollissima,4044573.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Leotiomycetes'],['Helotiales'],['Lachnaceae'],['Unknown'],['Lachnum'],['Belonidium mollissimum'],1,0,2.459587335586548 3887,4716,-1,,,,0.36489683,ISDB,KSIWZCYBCSQXTA-VHZBQWTKSA-N,"InChI=1S/C29H43NO5/c1-6-20(2)15-22(4)17-23(5)16-21(3)11-9-7-8-10-12-27(33)30-24(19-31)18-29(34)26(32)14-13-25-28(29)35-25/h7-15,20-21,23-25,28,31,34H,6,16-19H2,1-5H3,(H,30,33)/b8-7+,11-9+,12-10+,22-15+/t20-,21+,23-,24+,25+,28+,29-/m1/s1",CC[C@@H](C)/C=C(\C)C[C@H](C)C[C@@H](C)/C=C/C=C/C=C/C(=O)N[C@H](CO)C[C@@]1(O)C(=O)C=C[C@@H]2O[C@@H]21,C29H43NO5,,485.314123476,KSIWZCYBCSQXTA,Polyketides,Linear polyketides,Open-chain polyketides,Lachnella sauteri,4045187.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Leotiomycetes'],['Helotiales'],['Lachnaceae'],['Unknown'],['Lachnum'],['Lachnella sauteri'],1,0,2.459587335586548 3888,4715,306,Amino acids and Peptides,Small peptides,Dipeptides,0.2841002,ISDB,MLTRLIITQPXHBJ-BQBZGAKWSA-N,"InChI=1S/C10H19N3O4/c1-5(2)3-6(11)9(15)13-7(10(16)17)4-8(12)14/h5-7H,3-4,11H2,1-2H3,(H2,12,14)(H,13,15)(H,16,17)/t6-,7-/m0/s1",CC(C)C[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)O,C10H19N3O4,,245.137556088,MLTRLIITQPXHBJ,Amino acids and Peptides,Small peptides,Dipeptides,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,3,3.636400818824768 3889,4715,306,Amino acids and Peptides,Small peptides,Dipeptides,0.2841002,ISDB,MLTRLIITQPXHBJ-BQBZGAKWSA-N,"InChI=1S/C10H19N3O4/c1-5(2)3-6(11)9(15)13-7(10(16)17)4-8(12)14/h5-7H,3-4,11H2,1-2H3,(H2,12,14)(H,13,15)(H,16,17)/t6-,7-/m0/s1",CC(C)C[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)O,C10H19N3O4,,245.137556088,MLTRLIITQPXHBJ,Amino acids and Peptides,Small peptides,Dipeptides,Ambystoma mexicanum,984726.0,['Eukaryota'],['Metazoa'],['Chordata'],['Amphibia'],['Caudata'],['Ambystomatidae'],['Unknown'],['Ambystoma'],['Ambystoma mexicanum'],1,3,3.636400818824768 3890,4713,-1,,,,0.58062315,ISDB,RPVXENZJFAXSJY-GOEBONIOSA-N,"InChI=1S/C16H24O/c1-15(2)7-4-8-16(3)10-11-5-6-13(17)12(11)9-14(15)16/h14H,4-10H2,1-3H3/t14-,16+/m0/s1",CC1(C)CCC[C@]2(C)CC3=C(C[C@@H]12)C(=O)CC3,C16H24O,,232.182715388,RPVXENZJFAXSJY,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,Wurfbainia villosa,477379.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Wurfbainia'],['Wurfbainia villosa'],4,0,6.322492599487305 3891,4712,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1sodium1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3892,4712,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1sodium1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3893,4712,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1sodium1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3894,4712,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1sodium1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3895,4712,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1sodium1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 3896,4712,-1,,,,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1sodium1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3897,4712,-1,,,,0.0,MS1_match,OEGZSLZSZBSXQC-PBSSREKVSA-N,"InChI=1S/C16H22O8/c1-7(2)12(18)23-14-11-15(19)5-10(22-9(4)17)16(11,20)6-21-13(24-14)8(15)3/h7,10-11,13-14,19-20H,3,5-6H2,1-2,4H3/t10-,11-,13+,14+,15-,16-/m0/s1",C=C1[C@@H]2OC[C@]3(O)[C@@H](OC(C)=O)C[C@@]1(O)[C@@H]3[C@H](OC(=O)C(C)C)O2,C16H22O8,pos_1_1sodium1acetonitrile,342.131467664,OEGZSLZSZBSXQC,Terpenoids,Monoterpenoids,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3898,4702,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.7217392,ISDB,AWEDGODDRTXSDL-APACUCGBSA-N,"InChI=1S/C16H26O7/c1-8-5-4-6-16(2,3)10(8)14(21)23-15-13(20)12(19)11(18)9(7-17)22-15/h9,11-13,15,17-20H,4-7H2,1-3H3/t9-,11-,12+,13-,15+/m1/s1",CC1=C(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)CCC1,C16H26O7,,330.167853172,AWEDGODDRTXSDL,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Gardenia jasminoides,919367.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Gardenieae'],['Gardenia'],['Gardenia jasminoides'],4,2,7.886956691741943 3899,4701,700,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,FKARAOWYAAUAFW-MGRBCSRPSA-N,"InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20+,21-,24-,25+,26-,27-,28+/m1/s1",Cc1c(O)c(O)cc2c1CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H40O4,pos_2_2sodium,440.29265976,FKARAOWYAAUAFW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 3900,4701,700,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,FKARAOWYAAUAFW-MGRBCSRPSA-N,"InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20+,21-,24-,25+,26-,27-,28+/m1/s1",Cc1c(O)c(O)cc2c1CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H40O4,pos_2_2sodium,440.29265976,FKARAOWYAAUAFW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 3901,4700,-1,,,,0.0,MS1_match,XLYZUCCPECGBHX-GHCRHULKSA-N,"InChI=1S/C24H32O9/c1-12-7-8-16(30-13(2)25)23(6)20(32-21(28)15-9-10-29-11-15)18(27)17-19(31-14(3)26)24(12,23)33-22(17,4)5/h9-12,16-20,27H,7-8H2,1-6H3/t12-,16+,17-,18-,19-,20+,23+,24-/m1/s1",CC(=O)O[C@H]1CC[C@@H](C)[C@]23OC(C)(C)[C@H]([C@@H](O)[C@H](OC(=O)c4ccoc4)[C@]12C)[C@H]3OC(C)=O,C24H32O9,pos_1_1proton2acetonitrile,464.204632604,XLYZUCCPECGBHX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus boaria,418513.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus boaria'],6,0,6.0 3902,4695,-1,,,,0.5356616,ISDB,JDFAAKGOCYRYTJ-SECBINFHSA-N,"InChI=1S/C11H12O4/c1-15-9-5-4-7(13)10-6(12)2-3-8(14)11(9)10/h2-3,9,12,14H,4-5H2,1H3/t9-/m1/s1",CO[C@@H]1CCC(=O)c2c(O)ccc(O)c21,C11H12O4,,208.073558864,JDFAAKGOCYRYTJ,Polyketides,Naphthalenes,Naphthalenones,Juglans mandshurica,70093.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Juglans'],['Juglans mandshurica'],4,0,6.142646312713623 3903,4695,-1,,,,0.5356616,ISDB,JDFAAKGOCYRYTJ-VIFPVBQESA-N,"InChI=1S/C11H12O4/c1-15-9-5-4-7(13)10-6(12)2-3-8(14)11(9)10/h2-3,9,12,14H,4-5H2,1H3/t9-/m0/s1",CO[C@H]1CCC(=O)c2c(O)ccc(O)c21,C11H12O4,,208.073558864,JDFAAKGOCYRYTJ,Polyketides,Naphthalenes,Naphthalenones,Engelhardia roxburghiana,722586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Engelhardia'],['Engelhardia roxburghiana'],4,0,6.142646312713623 3904,4695,-1,,,,0.5356616,ISDB,JDFAAKGOCYRYTJ-SECBINFHSA-N,"InChI=1S/C11H12O4/c1-15-9-5-4-7(13)10-6(12)2-3-8(14)11(9)10/h2-3,9,12,14H,4-5H2,1H3/t9-/m1/s1",CO[C@@H]1CCC(=O)c2c(O)ccc(O)c21,C11H12O4,,208.073558864,JDFAAKGOCYRYTJ,Polyketides,Naphthalenes,Naphthalenones,Juglans regia,138717.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Juglans'],['Juglans regia'],4,0,6.142646312713623 3905,4694,-1,,,,0.43995163,ISDB,KCSKCIQYNAOBNQ-OKPRWBIXSA-N,"InChI=1S/C10H16N2O4S/c13-8(14)4-2-1-3-7-9-6(5-17(7)16)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-,17-/m0/s1",O=C(O)CCCC[C@H]1[C@H]2NC(=O)N[C@H]2C[S@+]1[O-],C10H16N2O4S,,260.083077992,KCSKCIQYNAOBNQ,Alkaloids,,,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,0,2.759806513786316 3906,4694,-1,,,,0.43995163,ISDB,KCSKCIQYNAOBNQ-OKPRWBIXSA-N,"InChI=1S/C10H16N2O4S/c13-8(14)4-2-1-3-7-9-6(5-17(7)16)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-,17-/m0/s1",O=C(O)CCCC[C@H]1[C@H]2NC(=O)N[C@H]2C[S@+]1[O-],C10H16N2O4S,,260.083077992,KCSKCIQYNAOBNQ,Alkaloids,,,Aspergillus niger,120377.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus niger'],1,0,2.759806513786316 3907,4688,-1,,,,0.34962055,ISDB,JDGRHJLOLKKFQC-YAOIVLIJSA-N,"InChI=1S/C11H14O7/c12-4-6-7(13)9(15)10(16)11(18-6)8(14)5-2-1-3-17-5/h1-3,6-7,9-13,15-16H,4H2/t6-,7-,9+,10-,11+/m1/s1",O=C(c1ccco1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C11H14O7,,258.07395278800004,JDGRHJLOLKKFQC,,,,Scleropyrum pentandrum,443751.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Santalales'],['Santalaceae'],['Unknown'],['Scleropyrum'],['Scleropyrum pentandrum'],4,0,5.3984822034835815 3908,4686,1197,,,,0.20687105,ISDB,SCLGLFRXJNHKQZ-GIBQNNFTSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7+,8-,9+,10-,11+,12+/m0/s1",C[C@@H]1OC=C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Saponaria officinalis,842209.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Saponaria'],['Saponaria officinalis'],4,0,4.82748419046402 3909,4686,1197,,,,0.20687105,ISDB,SCLGLFRXJNHKQZ-XFLMTTEOSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7+,8+,9+,10-,11+,12+/m0/s1",C[C@@H]1OC=C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Dianthus deltoides,188564.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus deltoides'],4,0,4.82748419046402 3910,4686,1197,,,,0.20687105,ISDB,SCLGLFRXJNHKQZ-XFLMTTEOSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7+,8+,9+,10-,11+,12+/m0/s1",C[C@@H]1OC=C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Dianthus barbatus,590078.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus barbatus'],4,0,4.82748419046402 3911,4686,1197,,,,0.20687105,ISDB,SCLGLFRXJNHKQZ-FYKVHUBJSA-N,"InChI=1S/C12H20O8/c1-5-8(14)6(2-3-18-5)19-12-11(17)10(16)9(15)7(4-13)20-12/h2-3,5-17H,4H2,1H3/t5-,6-,7-,8-,9-,10+,11-,12-/m1/s1",C[C@H]1OC=C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O,C12H20O8,,292.1158176,SCLGLFRXJNHKQZ,,,,Dianthus longicalyx,904393.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus longicalyx'],4,0,4.82748419046402 3912,4683,993,Terpenoids,Diterpenoids,Aromatic polyketides with side chains,0.54785335,ISDB,JDKUSIUPEUOZEW-MUFKJQONSA-N,"InChI=1S/C24H38O6/c1-16(11-13-25)10-12-23(3)18(15-30-22(29)9-8-21(27)28)19(26)14-24(4)17(2)6-5-7-20(23)24/h6,11,18-20,25-26H,5,7-10,12-15H2,1-4H3,(H,27,28)/b16-11+/t18-,19+,20-,23+,24+/m1/s1",CC1=CCC[C@@H]2[C@@](C)(CC/C(C)=C/CO)[C@H](COC(=O)CCC(=O)O)[C@@H](O)C[C@@]12C,C24H38O6,,422.266838936,JDKUSIUPEUOZEW,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Baccharis pteronioides,3898913.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Baccharis'],['Baccharis pteronioides'],4,2,7.191413402557373 3913,4680,-1,,,,0.0,MS1_match,CBIQGHYKUKDTIF-DBOWSLRKSA-N,"InChI=1S/C52H78O25/c1-20-14-70-52(43(63)35(20)59)29(15-66-22(3)54)34-32(77-52)13-28-26-8-7-24-11-25(56)12-33(50(24,6)27(26)9-10-49(28,34)5)73-47-42(40(31(58)17-68-47)74-45-37(61)36(60)30(57)16-67-45)76-46-38(62)41(39(21(2)71-46)72-23(4)55)75-48-44(64)51(65,18-53)19-69-48/h7,21,25-48,53,56-65H,1,8-19H2,2-6H3/t21-,25+,26+,27-,28-,29-,30+,31-,32-,33+,34-,35-,36-,37+,38+,39-,40-,41-,42+,43-,44-,45-,46-,47-,48-,49-,50-,51+,52-/m0/s1",C=C1CO[C@@]2(O[C@H]3C[C@H]4[C@@H]5CC=C6C[C@@H](O)C[C@@H](O[C@@H]7OC[C@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]7O[C@@H](C)[C@H](OC(C)=O)[C@@H](O[C@@H]8OC[C@](O)(CO)[C@H]8O)[C@H]7O)[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2COC(C)=O)[C@@H](O)[C@H]1O,C52H78O25,pos_2_2proton2acetonitrile,1102.483217996,CBIQGHYKUKDTIF,Terpenoids,Steroids,Spirostane steroids,Helleborus orientalis,648046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus orientalis'],6,0,6.0 3914,4671,-1,,,,0.0,MS1_match,ZYGHJZDHTFUPRJ-UHFFFAOYSA-N,InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,O=c1ccc2ccccc2o1,C9H6O2,pos_2MH,146.036779432,ZYGHJZDHTFUPRJ,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,0,6.0 3915,4670,826,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,0.0,MS1_match,FMRHJJZUHUTGKE-UHFFFAOYSA-N,"InChI=1S/C15H22O3/c1-3-5-8-12(4-2)11-18-15(17)13-9-6-7-10-14(13)16/h6-7,9-10,12,16H,3-5,8,11H2,1-2H3",CCCCC(CC)COC(=O)c1ccccc1O,C15H22O3,pos_2MHNH3,250.156894564,FMRHJJZUHUTGKE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 3916,4668,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.47950894,ISDB,NSOPGAYUGBZWHL-YTWBPVBXSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,2,6.9180357456207275 3917,4668,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.47950894,ISDB,NSOPGAYUGBZWHL-UHFFFAOYSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC=CCC=CCC=CCC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,2,6.9180357456207275 3918,4668,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.47950894,ISDB,NSOPGAYUGBZWHL-UHFFFAOYSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC=CCC=CCC=CCC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Angelica sinensis,182228.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Angelica'],['Angelica sinensis'],4,2,6.9180357456207275 3919,4665,394,Fatty acids,Fatty amides,Wax monoesters,0.0,MS1_match,AOGQPLXWSUTHQB-UHFFFAOYSA-N,"InChI=1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3",CCCCCCOC(C)=O,C8H16O2,pos_2MHCH3CN,144.115029752,AOGQPLXWSUTHQB,Fatty acids,Fatty esters,Wax monoesters,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 3920,4664,397,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),,0.0,MS1_match,LAQYHRQFABOIFD-UHFFFAOYSA-N,"InChI=1S/C7H8O3/c1-10-7-4-5(8)2-3-6(7)9/h2-4,8-9H,1H3",COc1cc(O)ccc1O,C7H8O3,pos_1_1proton1ammonium,140.047344116,LAQYHRQFABOIFD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,2,7.0 3921,4663,-1,,,,0.30560356,ISDB,,,,,,,AGTPCXBHIGMTEU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.222414255142212 3922,4660,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,OYHQOLUKZRVURQ-AVQMFFATSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6+,10-9+",CCCCC/C=C/C/C=C/CCCCCCCC(=O)O,C18H32O2,pos_1_1proton1acetonitrile,280.240230264,OYHQOLUKZRVURQ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,3,7.5 3923,4660,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,OYHQOLUKZRVURQ-HZJYTTRNSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)O,C18H32O2,pos_1_1proton1acetonitrile,280.240230264,OYHQOLUKZRVURQ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,3,7.5 3924,4660,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ADHNUPOJJCKWRT-JLXBFWJWSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h14-17H,2-13H2,1H3,(H,19,20)/b15-14+,17-16+",CCCCCCCCCCCCC/C=C/C=C/C(=O)O,C18H32O2,pos_1_1proton1acetonitrile,280.240230264,ADHNUPOJJCKWRT,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,3,7.5 3925,4659,-1,,,,0.0,MS1_match,GJOKUHOJKKOIEW-UHFFFAOYSA-N,"InChI=1S/C12H14O6/c1-7(4-13)12(17)3-11(18-8(2)16)9(5-14)10(12)6-15/h4,6,11,14,17H,1,3,5H2,2H3",C=C(C=O)C1(O)CC(OC(C)=O)C(CO)=C1C=O,C12H14O6,pos_1_1proton1acetonitrile,254.079038168,GJOKUHOJKKOIEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3926,4658,-1,,,,0.6146991,ISDB,ZCCLDKGWJIREQF-PDBXOOCHSA-N,"InChI=1S/C21H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h3-4,6-7,9-10,20,22-23H,2,5,8,11-19H2,1H3/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO,C21H36O4,,352.261359632,ZCCLDKGWJIREQF,Fatty acids,Glycerolipids,Monoacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,0,6.458796501159668 3927,4657,-1,,,,0.4983094,ISDB,RWNMKVWJIWFKJP-DIACKHNESA-N,"InChI=1S/C14H18O9/c1-6-13(8(16)3-4-20-6)23-14-12(19)11(18)10(17)9(22-14)5-21-7(2)15/h3-4,9-12,14,17-19H,5H2,1-2H3/t9-,10-,11+,12-,14+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(C)occc2=O)[C@H](O)[C@@H](O)[C@@H]1O,C14H18O9,,330.095082156,RWNMKVWJIWFKJP,Polyketides,,,Prangos pabularia,795193.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Unknown'],['Prangos'],['Prangos pabularia'],4,0,5.993237614631653 3928,4652,306,Amino acids and Peptides,Small peptides,Dipeptides,0.48567665,ISDB,ZVDPYSVOZFINEE-BQBZGAKWSA-N,"InChI=1S/C10H18N2O5/c1-5(2)3-7(10(16)17)12-9(15)6(11)4-8(13)14/h5-7H,3-4,11H2,1-2H3,(H,12,15)(H,13,14)(H,16,17)/t6-,7-/m0/s1",CC(C)C[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)O,C10H18N2O5,,246.121571676,ZVDPYSVOZFINEE,Amino acids and Peptides,Small peptides,Dipeptides,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,3,7.44270658493042 3929,4651,-1,,,,0.0,MS1_match,GZXHWPFETLWFJR-GAFPIEJNSA-N,"InChI=1S/C34H42O11/c1-8-18(2)29(37)42-23-16-19(3)34-26(36)24(32(5,6)45-34)25(43-31(39)22-14-15-40-17-22)28(33(34,7)27(23)41-20(4)35)44-30(38)21-12-10-9-11-13-21/h9-15,17-19,23-28,36H,8,16H2,1-7H3/t18-,19-,23+,24-,25-,26-,27+,28+,33+,34-/m1/s1",CC[C@@H](C)C(=O)O[C@H]1C[C@@H](C)[C@]23OC(C)(C)[C@H]([C@@H](OC(=O)c4ccoc4)[C@H](OC(=O)c4ccccc4)[C@]2(C)[C@H]1OC(C)=O)[C@H]3O,C34H42O11,pos_2_2sodium,626.2727121639999,GZXHWPFETLWFJR,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus rosthornianus,458804.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus rosthornianus'],6,0,6.0 3930,4640,-1,,,,0.3076222,ISDB,USYOOQFISINJLZ-IBAOYMAMSA-N,"InChI=1S/C23H34O6/c1-14(24)29-23(19(27)28-4)13-22-11-8-16-20(2,17(22)7-6-15(23)12-22)9-5-10-21(16,3)18(25)26/h15-17H,5-13H2,1-4H3,(H,25,26)/t15-,16+,17+,20-,21-,22+,23-/m1/s1",COC(=O)[C@@]1(OC(C)=O)C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)O)[C@@H]2CC[C@@H]1C3,C23H34O6,,406.235538808,USYOOQFISINJLZ,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Annona glabra,209798.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona glabra'],4,0,5.2304887771606445 3931,4630,413,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.20451538,ISDB,,,,,,,ATMJFTPNMIAKJH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8180615305900574 3932,4628,625,Terpenoids,Diterpenoids,Pregnane steroids,0.0,MS1_match,YQHBJMHUMJXFDN-KKSFZXQISA-N,"InChI=1S/C21H26O4/c1-11(2)14-9-17(22)18-13(19(14)24-4)5-6-16-15-10-25-20(23)12(15)7-8-21(16,18)3/h9,11,16,22H,5-8,10H2,1-4H3/t16-,21-/m0/s1",COc1c(C(C)C)cc(O)c2c1CC[C@H]1C3=C(CC[C@]21C)C(=O)OC3,C21H26O4,pos_1_sodium,342.18310931199994,YQHBJMHUMJXFDN,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,2,7.0 3933,4628,625,Terpenoids,Diterpenoids,Pregnane steroids,0.0,MS1_match,YQHBJMHUMJXFDN-KKSFZXQISA-N,"InChI=1S/C21H26O4/c1-11(2)14-9-17(22)18-13(19(14)24-4)5-6-16-15-10-25-20(23)12(15)7-8-21(16,18)3/h9,11,16,22H,5-8,10H2,1-4H3/t16-,21-/m0/s1",COc1c(C(C)C)cc(O)c2c1CC[C@H]1C3=C(CC[C@]21C)C(=O)OC3,C21H26O4,pos_1_sodium,342.18310931199994,YQHBJMHUMJXFDN,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,2,7.0 3934,4628,625,Terpenoids,Diterpenoids,Pregnane steroids,0.0,MS1_match,OMQCFSSTPCOICJ-UHFFFAOYSA-N,"InChI=1S/C21H26O4/c1-11(2)12-5-6-15-18(19(12)24-4)17(22)9-16-14-10-25-20(23)13(14)7-8-21(15,16)3/h5-6,11,16-17,22H,7-10H2,1-4H3",COc1c(C(C)C)ccc2c1C(O)CC1C3=C(CCC21C)C(=O)OC3,C21H26O4,pos_1_sodium,342.183109312,OMQCFSSTPCOICJ,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,2,7.0 3935,4626,9,Terpenoids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,MBDOYVRWFFCFHM-SNAWJCMRSA-N,"InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+",CCC/C=C/C=O,C6H10O,pos_2MHCH3CN,98.07316494,MBDOYVRWFFCFHM,Fatty acids,Fatty acyls,Fatty aldehydes,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 3936,4622,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.25196505,ISDB,,,,,,,NGTPNCMIHZRDSX,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0078601837158203 3937,4621,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.5734557,ISDB,VHFYCADQVMYJEI-OCCSQVGLSA-N,"InChI=1S/C14H22/c1-10(2)13-8-7-12-6-4-5-11(3)14(12)9-13/h12,14H,3-9H2,1-2H3/t12-,14+/m1/s1",C=C1CCC[C@@H]2CCC(=C(C)C)C[C@@H]12,C14H22,,190.172150704,VHFYCADQVMYJEI,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Trichogonia salviifolia,5739079.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Trichogonia'],['Trichogonia salviifolia'],4,3,7.793822765350342 3938,4614,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,10.499311685562134 3939,4614,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,3,10.499311685562134 3940,4614,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,10.499311685562134 3941,4611,-1,,,,0.0,MS1_match,NJZKNNCKRZJHCK-OGGREQCXSA-N,"InChI=1S/C30H34O16/c31-12-19-23(36)25(38)28(41)30(44-19)46-22(35)10-5-15-3-8-18(17(33)11-15)43-29-27(40)26(39)24(37)20(45-29)13-42-21(34)9-4-14-1-6-16(32)7-2-14/h1-11,19-20,23-33,36-41H,12-13H2/b9-4+,10-5+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O16,pos_2_2sodium,650.1846850080001,NJZKNNCKRZJHCK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3942,4611,-1,,,,0.0,MS1_match,HFIRFUKEPOQTLQ-KTFGOVRASA-N,"InChI=1S/C30H34O16/c31-12-19-23(36)25(38)28(41)30(44-19)46-22(35)10-4-14-1-6-16(7-2-14)43-29-27(40)26(39)24(37)20(45-29)13-42-21(34)9-5-15-3-8-17(32)18(33)11-15/h1-11,19-20,23-33,36-41H,12-13H2/b9-5+,10-4+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O16,pos_2_2sodium,650.184685008,HFIRFUKEPOQTLQ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3943,4611,-1,,,,0.0,MS1_match,NLMURPQWNRGYTM-OGGREQCXSA-N,"InChI=1S/C30H34O16/c31-12-19-23(36)25(38)28(41)30(44-19)46-22(35)10-5-15-3-8-17(33)18(11-15)43-29-27(40)26(39)24(37)20(45-29)13-42-21(34)9-4-14-1-6-16(32)7-2-14/h1-11,19-20,23-33,36-41H,12-13H2/b9-4+,10-5+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2cc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O16,pos_2_2sodium,650.1846850080001,NLMURPQWNRGYTM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 3944,4610,-1,,,,0.0,MS1_match,WLYRYWQOUXKANL-JMJQRBITSA-N,"InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5,8-9H,4,6-7H2,1-3H3/b9-8-,10-5+",C/C=C(\C)C(=O)O/C=C\CCCC,C11H18O2,pos_1_1proton2acetonitrile,182.130679816,WLYRYWQOUXKANL,,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3945,4610,-1,,,,0.0,MS1_match,JNWQKXUWZWKUAY-JQEGGOPCSA-N,"InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5+",C/C=C(\C)C(=O)OCC/C=C\CC,C11H18O2,pos_1_1proton2acetonitrile,182.130679816,JNWQKXUWZWKUAY,Fatty acids,Fatty esters,Wax monoesters,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3946,4609,-1,,,,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_1_1proton,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 3947,4604,700,Amino acids and Peptides,Small peptides,Dipeptides,0.86514235,ISDB,NFDYGNFETJVMSE-BQBZGAKWSA-N,"InChI=1S/C9H18N2O4/c1-5(2)3-7(9(14)15)11-8(13)6(10)4-12/h5-7,12H,3-4,10H2,1-2H3,(H,11,13)(H,14,15)/t6-,7-/m0/s1",CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O,C9H18N2O4,,218.126657056,NFDYGNFETJVMSE,Amino acids and Peptides,Small peptides,Dipeptides,Aeromonas veronii,704628.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Gammaproteobacteria'],['Aeromonadales'],['Aeromonadaceae'],['Unknown'],['Aeromonas'],['Aeromonas veronii'],0,3,4.960569381713867 3948,4602,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.53718984,ISDB,BWISWMPEIXFANG-UHFFFAOYSA-N,"InChI=1S/C21H38O5/c1-2-3-4-5-6-8-11-14-19(24)15-12-9-7-10-13-16-21(25)26-20(17-22)18-23/h6,8,20,22-23H,2-5,7,9-18H2,1H3",CCCCCC=CCCC(=O)CCCCCCCC(=O)OC(CO)CO,C21H38O5,,370.271924316,BWISWMPEIXFANG,Fatty acids,Glycerolipids,Monoacylglycerols,Ipomoea nil,77355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Convolvulaceae'],['Ipomoeeae'],['Ipomoea'],['Ipomoea nil'],4,1,6.648759365081787 3949,4600,903,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,RRAFCDWBNXTKKO-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3",C=CCc1ccc(O)c(OC)c1,C10H12O2,pos_1_1proton,164.083729624,RRAFCDWBNXTKKO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3950,4600,903,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LREHGXOCZVBABG-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-5-8-6-4-7-9(12-2)10(8)11/h3-4,6-7,11H,1,5H2,2H3",C=CCc1cccc(OC)c1O,C10H12O2,pos_1_1proton,164.083729624,LREHGXOCZVBABG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 3951,4598,-1,,,,0.30295056,ISDB,XRIDGQVLGQMCMX-OLEFQQMKSA-N,"InChI=1S/C15H16O7/c1-20-12-6-9(2-4-10(12)16)3-5-14(18)21-8-13-11(17)7-15(19)22-13/h2-6,11,13,16-17H,7-8H2,1H3/b5-3+/t11-,13+/m0/s1",COc1cc(/C=C/C(=O)OC[C@H]2OC(=O)C[C@@H]2O)ccc1O,C15H16O7,,308.089602852,XRIDGQVLGQMCMX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],4,0,5.211802244186401 3952,4596,136,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZYEMGPIYFIJGTP-UHFFFAOYSA-N,"InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3",C=CCc1ccc(OC)c(OC)c1,C11H14O2,pos_2MH,178.099379688,ZYEMGPIYFIJGTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,3,7.5 3953,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Brassica juncea,309279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica juncea'],4,0,5.625750660896301 3954,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Brassica rapa,833632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica rapa'],4,0,5.625750660896301 3955,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Helianthus tuberosus,515709.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Helianthus'],['Helianthus tuberosus'],4,0,5.625750660896301 3956,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Vitis rotundifolia,650748.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis rotundifolia'],4,0,5.625750660896301 3957,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Gossypium hirsutum,854480.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Gossypium'],['Gossypium hirsutum'],4,0,5.625750660896301 3958,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Carica papaya,429474.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Caricaceae'],['Unknown'],['Carica'],['Carica papaya'],4,0,5.625750660896301 3959,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,0,5.625750660896301 3960,4595,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.40643767,ISDB,ODLMAHJVESYWTB-UHFFFAOYSA-N,"InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3",CCCc1ccccc1,C9H12,,120.093900384,ODLMAHJVESYWTB,,,,Brassica campestris,833632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica rapa'],4,0,5.625750660896301 3961,4590,-1,,,,0.28395617,ISDB,JLUQTCXCAFSSLD-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c11-7-1-3-9(13-7)5-6-10(9)4-2-8(12)14-10/h1-4H,5-6H2",O=C1C=CC2(CCC23C=CC(=O)O3)O1,C10H8O4,,192.042258736,JLUQTCXCAFSSLD,Shikimates and Phenylpropanoids,,,Clematis hirsutissima,3945124.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hirsutissima'],8,0,9.13582468032837 3962,4589,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1potassium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3963,4589,-1,,,,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1potassium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3964,4589,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3965,4589,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3966,4589,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3967,4589,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3968,4589,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1potassium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 3969,4589,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1potassium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 3970,4585,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.8308776,ISDB,OIIJXQMSEYQDDI-UHFFFAOYSA-N,"InChI=1S/C13H18/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h7-8,10H,4-6H2,1-3H3",Cc1ccc(C)c2c1CCCC2C,C13H18,,174.140850576,OIIJXQMSEYQDDI,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.82351040840149 3971,4584,700,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,WYJTXYYWNRUUBH-DTWKUNHWSA-N,"InChI=1S/C10H14N2O3/c1-14-10(13)8-4-6-15-9(12-8)7-3-2-5-11-7/h2-3,5,8-9,11-12H,4,6H2,1H3/t8-,9+/m0/s1",COC(=O)[C@@H]1CCO[C@H](c2ccc[nH]2)N1,C10H14N2O3,pos_1_1proton1methanol,210.100442308,WYJTXYYWNRUUBH,Alkaloids,,,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,0,6.0 3972,4583,-1,,,,0.0,MS1_match,AQOVEYNSQFBSQX-STMBSLSDSA-N,"InChI=1S/C16H20O5/c1-4-13(11-17)16(18)21-9-5-6-12-7-8-14(19-2)15(10-12)20-3/h4-8,10,17H,9,11H2,1-3H3/b6-5+,13-4-",C/C=C(/CO)C(=O)OC/C=C/c1ccc(OC)c(OC)c1,C16H20O5,pos_1_1proton1ammonium,292.13107374,AQOVEYNSQFBSQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 3973,4583,-1,,,,0.0,MS1_match,YDYHOAALGZGNKR-IVTISIJFSA-N,"InChI=1S/C28H40O10/c1-8-18(6)11-25(32)37-22-12-21-20(13-34-19(7)29)14-35-27(38-24(31)10-17(4)5)26(21)28(22,33)15-36-23(30)9-16(2)3/h10,12,14,16,18,22,26-27,33H,8-9,11,13,15H2,1-7H3/t18-,22-,26+,27-,28+/m0/s1",CC[C@H](C)CC(=O)O[C@H]1C=C2C(COC(C)=O)=CO[C@@H](OC(=O)C=C(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)C,C28H40O10,pos_2_2proton2acetonitrile,536.26214748,YDYHOAALGZGNKR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 3974,4582,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3975,4582,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 3976,4582,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3977,4582,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 3978,4581,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,QPJVMBTYPHYUOC-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3",COC(=O)c1ccccc1,C8H8O2,pos_2MHNH3,136.052429496,QPJVMBTYPHYUOC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 3979,4574,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OUWXZGMEFZQYEK-WQLSENKSSA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(8-12(4)16(17)18)15-11(3)7-10(2)14(9)15/h8-10,13-14H,5-7H2,1-4H3,(H,17,18)/b12-8-",CC1=C2C(/C=C(/C)C(=O)O)CCC(C)C2C(C)C1,C16H24O2,pos_1_1proton,248.177630008,OUWXZGMEFZQYEK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 3980,4574,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,FAGPISMIHLVLSK-JWFUOXDNSA-N,"InChI=1S/C15H20O/c1-9-7-11(16)8-10-5-6-12-13(14(12,2)3)15(9,10)4/h5-6,8-9,12-13H,7H2,1-4H3/t9-,12-,13+,15+/m1/s1",C[C@@H]1CC(=O)C=C2C=C[C@@H]3[C@@H](C3(C)C)[C@]21C,C15H20O,pos_1_1proton1methanol,216.15141526,FAGPISMIHLVLSK,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,1,6.5 3981,4574,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,FAGPISMIHLVLSK-JWFUOXDNSA-N,"InChI=1S/C15H20O/c1-9-7-11(16)8-10-5-6-12-13(14(12,2)3)15(9,10)4/h5-6,8-9,12-13H,7H2,1-4H3/t9-,12-,13+,15+/m1/s1",C[C@@H]1CC(=O)C=C2C=C[C@@H]3[C@@H](C3(C)C)[C@]21C,C15H20O,pos_1_1proton1methanol,216.15141526,FAGPISMIHLVLSK,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 3982,4574,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,TYPSVDGIQAOBAD-DZGCQCFKSA-N,"InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1",C=C1CCC[C@]2(C)Cc3occ(C)c3C[C@@H]12,C15H20O,pos_1_1proton1methanol,216.15141526,TYPSVDGIQAOBAD,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 3983,4574,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,TYPSVDGIQAOBAD-DZGCQCFKSA-N,"InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1",C=C1CCC[C@]2(C)Cc3occ(C)c3C[C@@H]12,C15H20O,pos_1_1proton1methanol,216.15141526,TYPSVDGIQAOBAD,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 3984,4573,293,Polyketides,Aromatic polyketides,Dammarane and Protostane triterpenoids,0.45406497,ISDB,PDKQWVGVSXAXRB-UHFFFAOYSA-N,"InChI=1S/C24H38O3/c1-14(25)15-7-11-24(6)20(15)16(26)13-18-22(4)10-9-19(27)21(2,3)17(22)8-12-23(18,24)5/h15-18,20,26H,7-13H2,1-6H3",CC(=O)C1CCC2(C)C1C(O)CC1C3(C)CCC(=O)C(C)(C)C3CCC12C,C24H38O3,,374.282095076,PDKQWVGVSXAXRB,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Viburnum cylindricum,205162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum cylindricum'],5,3,8.316259860992432 3985,4572,-1,,,,0.65723616,ISDB,CKWHKLRCBIYFOZ-UHFFFAOYSA-N,"InChI=1S/C19H20O11/c20-7-13-15(24)16(25)17(26)19(30-13)29-10-3-1-9(2-4-10)28-18(27)8-5-11(21)14(23)12(22)6-8/h1-6,13,15-17,19-26H,7H2",O=C(Oc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1)c1cc(O)c(O)c(O)c1,C19H20O11,,424.10056146,CKWHKLRCBIYFOZ,Polyketides,Aromatic polyketides,Depsides,Arctostaphylos uva-ursi,100960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Unknown'],['Arctostaphylos'],['Arctostaphylos uva-ursi'],4,0,6.628944635391235 3986,4570,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.42485252,ISDB,GPIJMIWHLZJMMT-SJPVLFDFSA-N,"InChI=1S/C11H18O9/c12-2-5-4(1-7(14)18-5)19-11-10(17)9(16)8(15)6(3-13)20-11/h4-6,8-13,15-17H,1-3H2/t4-,5+,6+,8+,9-,10+,11+/m0/s1",O=C1C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O1,C11H18O9,,294.095082156,GPIJMIWHLZJMMT,,,,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,9.699410080909729 3987,4564,-1,,,,0.26322213,ISDB,BJIOGJUNALELMI-ONEGZZNKSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+",C/C=C/c1ccc(O)c(OC)c1,C10H12O2,,164.083729624,BJIOGJUNALELMI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,7.052888512611389 3988,4564,-1,,,,0.26322213,ISDB,BJIOGJUNALELMI-ONEGZZNKSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+",C/C=C/c1ccc(O)c(OC)c1,C10H12O2,,164.083729624,BJIOGJUNALELMI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,7.052888512611389 3989,4559,-1,,,,0.3357913,ISDB,,,,,,,CGTVVCFTVVGYPL,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3431651592254639 3990,4557,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.30223918,ISDB,DLHGNEVRISSXIV-UHFFFAOYSA-N,"InChI=1S/C10H8O3/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5,11H,1H3",Cc1cc(=O)c2cccc(O)c2o1,C10H8O3,,176.047344116,DLHGNEVRISSXIV,Polyketides,Chromanes,Chromones,Halenia elliptica,862722.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Halenia'],['Halenia elliptica'],4,0,5.208956718444824 3991,4554,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,TZZAKSLHHIJRLL-UHFFFAOYSA-N,"InChI=1S/C8H9NO3/c1-12-7-4-5(8(9)11)2-3-6(7)10/h2-4,10H,1H3,(H2,9,11)",COc1cc(C(N)=O)ccc1O,C8H9NO3,pos_2MK,167.058243148,TZZAKSLHHIJRLL,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Naravelia zeylanica,274607.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Naravelia'],['Naravelia zeylanica'],7,0,7.0 3992,4548,-1,,,,0.64720345,ISDB,,,,,,,FBLNHSDBHNXKFB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.5888137817382812 3993,4547,-1,,,,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_1_1proton1ammonium,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 3994,4547,-1,,,,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_1_1proton1ammonium,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3995,4543,-1,,,,0.0,MS1_match,ZTKRNEHDDSFTES-RFHDDPBLSA-N,"InChI=1S/C12H15ClO6/c1-5-10-18-9(15)8-11(5,16)3-7(17-6(2)14)12(8,4-13)19-10/h7-10,15-16H,1,3-4H2,2H3/t7-,8-,9+,10-,11-,12+/m1/s1",C=C1[C@@H]2O[C@H](O)[C@H]3[C@@](CCl)(O2)[C@H](OC(C)=O)C[C@@]13O,C12H15ClO6,pos_1_1proton1acetonitrile,290.05571588,ZTKRNEHDDSFTES,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 3996,4543,-1,,,,0.0,MS1_match,ZTKRNEHDDSFTES-UHFFFAOYSA-N,"InChI=1S/C12H15ClO6/c1-5-10-18-9(15)8-11(5,16)3-7(17-6(2)14)12(8,4-13)19-10/h7-10,15-16H,1,3-4H2,2H3",C=C1C2OC(O)C3C1(O)CC(OC(C)=O)C3(CCl)O2,C12H15ClO6,pos_1_1proton1acetonitrile,290.05571588,ZTKRNEHDDSFTES,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 3997,4542,382,Fatty acids,Fatty esters,Wax monoesters,0.42327324,ISDB,YHIXRNNWDBPKPW-JOCHJYFZSA-N,"InChI=1S/C24H48NO8P/c1-6-8-10-12-14-16-23(26)30-20-22(33-24(27)17-15-13-11-9-7-2)21-32-34(28,29)31-19-18-25(3,4)5/h22H,6-21H2,1-5H3/t22-/m1/s1",CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC,C24H48NO8P,,509.311754126,YHIXRNNWDBPKPW,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Valsa sordida,382306.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Diaporthales'],['Valsaceae'],['Unknown'],['Valsa'],['Valsa sordida'],1,1,3.193092942237854 3998,4541,-1,,,,0.21063887,ISDB,DYFUVQSGLMQLRX-ALBXZGMBSA-N,"InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O10,,648.387347992,DYFUVQSGLMQLRX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.842555463314056 3999,4540,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.6128241,ISDB,WTLVYAWQAPUBFY-UTLPMFLDSA-N,"InChI=1S/C18H28O4/c1-2-3-4-6-11-16(19)13-9-10-14-17(20)12-7-5-8-15-18(21)22/h9-10,13-14H,2-8,11-12,15H2,1H3,(H,21,22)/b13-9+,14-10+",CCCCCCC(=O)/C=C/C=C/C(=O)CCCCCC(=O)O,C18H28O4,,308.198759376,WTLVYAWQAPUBFY,Fatty acids,Octadecanoids,Other Octadecanoids,Ostodes paniculata,1028448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Codiaeae'],['Ostodes'],['Ostodes paniculata'],4,0,6.451296329498291 4000,4539,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,BWOVJJVWAQOXMJ-UHFFFAOYSA-N,"InChI=1S/C28H36O11/c1-15(29)35-14-27-19(32)12-13-26(6,34)28(27)22(37-17(3)31)20(25(4,5)39-28)21(36-16(2)30)23(27)38-24(33)18-10-8-7-9-11-18/h7-11,19-23,32,34H,12-14H2,1-6H3",CC(=O)OCC12C(O)CCC(C)(O)C13OC(C)(C)C(C(OC(C)=O)C2OC(=O)c1ccccc1)C3OC(C)=O,C28H36O11,pos_1_minus1proton2sodium,548.225761972,BWOVJJVWAQOXMJ,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus canariensis,458948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia cassinoides'],6,2,7.0 4001,4539,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,BWOVJJVWAQOXMJ-WAPJGYJGSA-N,"InChI=1S/C28H36O11/c1-15(29)35-14-27-19(32)12-13-26(6,34)28(27)22(37-17(3)31)20(25(4,5)39-28)21(36-16(2)30)23(27)38-24(33)18-10-8-7-9-11-18/h7-11,19-23,32,34H,12-14H2,1-6H3/t19-,20+,21+,22+,23+,26-,27-,28-/m0/s1",CC(=O)OC[C@]12[C@H](OC(=O)c3ccccc3)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)CC[C@@H]2O,C28H36O11,pos_1_minus1proton2sodium,548.225761972,BWOVJJVWAQOXMJ,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Gymnosporia cassinoides,458948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia cassinoides'],6,2,7.0 4002,4539,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,FOFXBHAKMNFCKG-UHFFFAOYSA-N,"InChI=1S/C28H36O11/c1-15(29)35-14-27-19(36-16(2)30)12-13-26(6,34)28(27)22(37-17(3)31)20(25(4,5)39-28)21(32)23(27)38-24(33)18-10-8-7-9-11-18/h7-11,19-23,32,34H,12-14H2,1-6H3",CC(=O)OCC12C(OC(C)=O)CCC(C)(O)C13OC(C)(C)C(C(O)C2OC(=O)c1ccccc1)C3OC(C)=O,C28H36O11,pos_1_minus1proton2sodium,548.225761972,FOFXBHAKMNFCKG,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus canariensis,458948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia cassinoides'],6,2,7.0 4003,4539,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,FOFXBHAKMNFCKG-WAPJGYJGSA-N,"InChI=1S/C28H36O11/c1-15(29)35-14-27-19(36-16(2)30)12-13-26(6,34)28(27)22(37-17(3)31)20(25(4,5)39-28)21(32)23(27)38-24(33)18-10-8-7-9-11-18/h7-11,19-23,32,34H,12-14H2,1-6H3/t19-,20+,21+,22+,23+,26-,27-,28-/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(C)=O)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@@H](O)[C@H]2OC(=O)c1ccccc1)[C@H]3OC(C)=O,C28H36O11,pos_1_minus1proton2sodium,548.225761972,FOFXBHAKMNFCKG,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Gymnosporia cassinoides,458948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia cassinoides'],6,2,7.0 4004,4539,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,IIRHMKNKDSLPSJ-TWTSRNLUSA-N,"InChI=1S/C28H36O11/c1-15(29)35-14-27-19(38-24(33)18-10-8-7-9-11-18)12-13-26(6,34)28(27)22(36-16(2)30)20(25(4,5)39-28)21(32)23(27)37-17(3)31/h7-11,19-23,32,34H,12-14H2,1-6H3/t19-,20+,21-,22+,23+,26-,27-,28-/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(=O)c3ccccc3)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@H](O)[C@H]2OC(C)=O)[C@H]3OC(C)=O,C28H36O11,pos_1_minus1proton2sodium,548.225761972,IIRHMKNKDSLPSJ,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Rzedowskia tolantonguensis,332590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Rzedowskia'],['Rzedowskia tolantonguensis'],6,2,7.0 4005,4537,-1,,,,0.0,MS1_match,JRSACOBIDKCJGV-RKQHYHRCSA-N,"InChI=1S/C14H19NO8/c16-7-10-11(17)12(18)13(19)14(23-10)22-9-3-1-8(2-4-9)5-6-15(20)21/h1-4,10-14,16-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1",O=[N+]([O-])CCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C14H19NO8,pos_2_2proton1acetonitrile,329.111066568,JRSACOBIDKCJGV,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 4006,4537,-1,,,,0.0,MS1_match,MRIXVKKOHPQOFK-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4,9H,1H3,(H,10,11)",COc1ccc(C(=O)O)c(O)c1,C8H8O4,pos_1_1proton1ammonium,168.042258736,MRIXVKKOHPQOFK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 4007,4537,-1,,,,0.0,MS1_match,OLBNOBQOQZRLMP-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-11-6-3-5(9)4-7(12-2)8(6)10/h3-4H,1-2H3",COC1=CC(=O)C=C(OC)C1=O,C8H8O4,pos_1_1proton1ammonium,168.042258736,OLBNOBQOQZRLMP,Polyketides,Aromatic polyketides,Benzoquinones,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 4008,4537,-1,,,,0.0,MS1_match,CUFLZUDASVUNOE-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,9-10H,1H3",COC(=O)c1ccc(O)c(O)c1,C8H8O4,pos_1_1proton1ammonium,168.042258736,CUFLZUDASVUNOE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Delphinium venulosum,885408.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium venulosum'],6,0,6.0 4009,4537,-1,,,,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_1_1proton1ammonium,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,0,6.0 4010,4537,-1,,,,0.0,MS1_match,WIIDBJNWXCWLKF-VVAXPEBGSA-N,"InChI=1S/C14H19NO8/c15-4-3-6-1-2-7(17)9(18)13(6)23-14-12(21)11(20)10(19)8(5-16)22-14/h1-3,7-14,16-21H,5H2/b6-3-/t7-,8-,9+,10-,11+,12-,13+,14+/m1/s1",N#C/C=C1/C=C[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C14H19NO8,pos_2_2proton1acetonitrile,329.111066568,WIIDBJNWXCWLKF,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Thalictrum orientale,6133349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum orientale'],6,0,6.0 4011,4537,-1,,,,0.0,MS1_match,WIIDBJNWXCWLKF-VVAXPEBGSA-N,"InChI=1S/C14H19NO8/c15-4-3-6-1-2-7(17)9(18)13(6)23-14-12(21)11(20)10(19)8(5-16)22-14/h1-3,7-14,16-21H,5H2/b6-3-/t7-,8-,9+,10-,11+,12-,13+,14+/m1/s1",N#C/C=C1/C=C[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C14H19NO8,pos_2_2proton1acetonitrile,329.111066568,WIIDBJNWXCWLKF,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Semiaquilegia adoxoides,781970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Semiaquilegia'],['Semiaquilegia adoxoides'],6,0,6.0 4012,4537,-1,,,,0.0,MS1_match,JRSACOBIDKCJGV-RKQHYHRCSA-N,"InChI=1S/C14H19NO8/c16-7-10-11(17)12(18)13(19)14(23-10)22-9-3-1-8(2-4-9)5-6-15(20)21/h1-4,10-14,16-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1",O=[N+]([O-])CCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C14H19NO8,pos_2_2proton1acetonitrile,329.111066568,JRSACOBIDKCJGV,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 4013,4537,-1,,,,0.0,MS1_match,IZZIWIAOVZOBLF-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11)",COc1ccc(O)c(C(=O)O)c1,C8H8O4,pos_1_1proton1ammonium,168.042258736,IZZIWIAOVZOBLF,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Thalictrum fargesii,124386.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fargesii'],6,0,6.0 4014,4537,-1,,,,0.0,MS1_match,VXWUBYBAUIHOHG-DTLFHODZSA-N,"InChI=1S/C8H8O4/c9-5-2-1-4-3-6(10)12-8(4)7(5)11/h1-3,5,7-9,11H/t5-,7+,8+/m1/s1",O=C1C=C2C=C[C@@H](O)[C@H](O)[C@H]2O1,C8H8O4,pos_1_1proton1ammonium,168.042258736,VXWUBYBAUIHOHG,,,,Semiaquilegia adoxoides,781970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Semiaquilegia'],['Semiaquilegia adoxoides'],6,0,6.0 4015,4533,382,Fatty acids,Fatty esters,Wax monoesters,0.36566216,ISDB,MRETWXDTCCOEHE-FCZMTWNNSA-N,"InChI=1S/C27H39NO4/c1-6-17(2)14-19(4)16-20(5)15-18(3)12-13-22(29)23-26(31)24(28-27(23)32)25(30)21-10-8-7-9-11-21/h7-11,16-19,24-25,30-31H,6,12-15H2,1-5H3,(H,28,32)/b20-16+/t17?,18?,19?,24-,25-/m0/s1",CCC(C)CC(C)/C=C(\C)CC(C)CCC(=O)C1=C(O)[C@H]([C@@H](O)c2ccccc2)NC1=O,C27H39NO4,,441.287908728,MRETWXDTCCOEHE,Amino acids and Peptides,Linear polyketides,3-acyl tetramic acids,Fusarium,655794.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Nectriaceae'],['Unknown'],['Fusarium'],['Unknown'],1,0,2.462648630142212 4016,4532,767,Alkaloids,Lignans,3-Spirotetramic acids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_1_1proton1ammonium,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 4017,4532,767,Alkaloids,Lignans,3-Spirotetramic acids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_1_1proton1ammonium,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,2,8.0 4018,4531,-1,,,,0.0,MS1_match,RROGHRHLBLVQSG-ZIEWLMKPSA-N,"InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)53-34-32(28(45)23(44)19-51-34)54-33-31(48)30(47)29(46)24(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32-,33-,34-,37-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O13,pos_1_1proton1ammonium,766.450342172,RROGHRHLBLVQSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4019,4531,-1,,,,0.0,MS1_match,RROGHRHLBLVQSG-ZIEWLMKPSA-N,"InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)53-34-32(28(45)23(44)19-51-34)54-33-31(48)30(47)29(46)24(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32-,33-,34-,37-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O13,pos_1_1proton1ammonium,766.450342172,RROGHRHLBLVQSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4020,4528,-1,,,,0.0,MS1_match,OVSVTCFNLSGAMM-KGBODLQUSA-N,"InChI=1S/C40H62/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15,19-22,25,27-30H,13-14,16-18,23-24,26,31-32H2,1-10H3/b12-11?,25-15+,35-21+,36-22?,37-27?,38-28?,39-29+,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(C)/C=C/C=C(\C)CCC=C(C)CCC=C(C)C,C40H62,pos_3_2proton1sodium,542.485151984,OVSVTCFNLSGAMM,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4021,4525,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4022,4525,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4023,4524,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2816341,ISDB,YEQBGJNMHDZXRG-NMTUBSNHSA-N,"InChI=1S/C27H40O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h5,7-8,17-18,20-24H,6,9-16H2,1-4H3/t17-,18+,20-,21-,22-,23+,24+,25-,26+,27-/m0/s1",C[C@H]1CC[C@]2(OC1)O[C@@H]1C[C@H]3[C@H]4CC=C5C=CCC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]1[C@H]2C,C27H40O2,,396.30283051999993,YEQBGJNMHDZXRG,Terpenoids,Steroids,Spirostane steroids,Trigonella foenum-graecum,1007994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trigonella'],['Trigonella foenum-graecum'],4,1,5.6265363693237305 4024,4523,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 4025,4523,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 4026,4523,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 4027,4523,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 4028,4521,-1,,,,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_sodium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4029,4521,-1,,,,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_sodium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4030,4521,-1,,,,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_sodium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4031,4521,-1,,,,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_sodium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4032,4521,-1,,,,0.0,MS1_match,ORESVIJUAVPRJL-XUJNLDPJSA-N,"InChI=1S/C42H68O14/c1-20(2)21-9-14-42(37(52)56-36-34(51)32(49)30(47)24(18-44)54-36)16-15-40(5)22(28(21)42)7-8-26-38(3)12-11-27(39(4,19-45)25(38)10-13-41(26,40)6)55-35-33(50)31(48)29(46)23(17-43)53-35/h21-36,43-51H,1,7-19H2,2-6H3/t21-,22+,23+,24+,25+,26+,27-,28+,29+,30+,31-,32-,33+,34+,35-,36-,38-,39-,40+,41+,42-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12,C42H68O14,pos_1_sodium,796.460906856,ORESVIJUAVPRJL,Terpenoids,Triterpenoids,Lupane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4033,4519,-1,,,,0.7683789,ISDB,YPHQMIRXEFDOQM-UHFFFAOYSA-N,"InChI=1S/C18H30O3/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-3,5,7,9,19H,4,6,8,10-17H2,(H,20,21)",O=C(O)CCCCCCCC=CC=CC=CCCCCO,C18H30O3,,294.21949482,YPHQMIRXEFDOQM,Fatty acids,Fatty Acids and Conjugates,,Mallotus claoxyloides,339734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus claoxyloides'],4,0,7.0735156536102295 4034,4519,-1,,,,0.7683789,ISDB,YPHQMIRXEFDOQM-UHFFFAOYSA-N,"InChI=1S/C18H30O3/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-3,5,7,9,19H,4,6,8,10-17H2,(H,20,21)",O=C(O)CCCCCCCC=CC=CC=CCCCCO,C18H30O3,,294.21949482,YPHQMIRXEFDOQM,Fatty acids,Fatty Acids and Conjugates,,Mallotus discolor,762446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus discolor'],4,0,7.0735156536102295 4035,4519,-1,,,,0.7683789,ISDB,YPHQMIRXEFDOQM-UHFFFAOYSA-N,"InChI=1S/C18H30O3/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-3,5,7,9,19H,4,6,8,10-17H2,(H,20,21)",O=C(O)CCCCCCCC=CC=CC=CCCCCO,C18H30O3,,294.21949482,YPHQMIRXEFDOQM,Fatty acids,Fatty Acids and Conjugates,,Lotus discolor,70013.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus discolor'],4,0,7.0735156536102295 4036,4518,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6813435,ISDB,,,,,,,FBLNHSDBHNXKFB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.7253739833831787 4037,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,UVIHEQDHSJMULB-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)25-2)9(15(23)24)6-26-16(7)28-17-14(22)13(21)12(20)10(5-18)27-17/h3,6-8,10,12-14,16-18,20-22H,1,4-5H2,2H3,(H,23,24)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O)[C@H]1CC(=O)OC,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,UVIHEQDHSJMULB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4038,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QZCJFXSHMSZCLH-VVDJRVHTSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,9-,11+,12+,13+,14-,16-,17+/m0/s1",COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@H](C)OC(=O)C[C@H]12,C17H24O11,pos_1_1proton1ethylamine,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4039,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1proton1ethylamine,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],7,0,7.0 4040,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1proton1ethylamine,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 4041,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QZCJFXSHMSZCLH-VVDJRVHTSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,9-,11+,12+,13+,14-,16-,17+/m0/s1",COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@H](C)OC(=O)C[C@H]12,C17H24O11,pos_1_1proton1ethylamine,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4042,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1proton1ethylamine,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],7,0,7.0 4043,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1proton1ethylamine,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 4044,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 4045,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4046,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 4047,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 4048,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4049,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 4050,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 4051,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4052,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 4053,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,CZNFJYHDUOEVJW-YJTTYYMVSA-N,"InChI=1S/C17H24O11/c1-6-12-8(3-11(20)25-6)10(26-7(2)19)5-24-16(12)28-17-15(23)14(22)13(21)9(4-18)27-17/h5-6,8-9,12-18,21-23H,3-4H2,1-2H3/t6?,8-,9-,12-,13-,14+,15-,16+,17+/m1/s1",CC(=O)OC1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(C)OC(=O)C[C@H]12,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,CZNFJYHDUOEVJW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4054,4516,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,CZNFJYHDUOEVJW-YJTTYYMVSA-N,"InChI=1S/C17H24O11/c1-6-12-8(3-11(20)25-6)10(26-7(2)19)5-24-16(12)28-17-15(23)14(22)13(21)9(4-18)27-17/h5-6,8-9,12-18,21-23H,3-4H2,1-2H3/t6?,8-,9-,12-,13-,14+,15-,16+,17+/m1/s1",CC(=O)OC1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(C)OC(=O)C[C@H]12,C17H24O11,pos_1_1proton1ethylamine,404.1318615879998,CZNFJYHDUOEVJW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 4055,4514,-1,,,,0.0,MS1_match,DMKFLQFRXXCTNK-UHFFFAOYSA-N,"InChI=1S/C41H70O15/c1-18(32(31(50)33(51)37(4,5)52)56-35-30(49)28(47)27(46)21(15-42)54-35)25-19(43)14-39(7)23-9-8-22-36(2,3)24(55-34-29(48)26(45)20(44)16-53-34)10-11-40(22)17-41(23,40)13-12-38(25,39)6/h18-35,42-52H,8-17H2,1-7H3",CC(C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C(C)(C)O)C1C(O)CC2(C)C3CCC4C(C)(C)C(OC5OCC(O)C(O)C5O)CCC45CC35CCC12C,C41H70O15,pos_2_1proton1potassium,802.47147154,DMKFLQFRXXCTNK,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 4056,4514,-1,,,,0.0,MS1_match,DMKFLQFRXXCTNK-UHFFFAOYSA-N,"InChI=1S/C41H70O15/c1-18(32(31(50)33(51)37(4,5)52)56-35-30(49)28(47)27(46)21(15-42)54-35)25-19(43)14-39(7)23-9-8-22-36(2,3)24(55-34-29(48)26(45)20(44)16-53-34)10-11-40(22)17-41(23,40)13-12-38(25,39)6/h18-35,42-52H,8-17H2,1-7H3",CC(C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C(C)(C)O)C1C(O)CC2(C)C3CCC4C(C)(C)C(OC5OCC(O)C(O)C5O)CCC45CC35CCC12C,C41H70O15,pos_2_1proton1potassium,802.47147154,DMKFLQFRXXCTNK,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 4057,4510,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWYFCOCPABKNJV-UHFFFAOYSA-N,"InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)",CC(C)CC(=O)O,C5H10O2,pos_2MHCH3CN,102.06807956,GWYFCOCPABKNJV,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4058,4510,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWYFCOCPABKNJV-UHFFFAOYSA-N,"InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)",CC(C)CC(=O)O,C5H10O2,pos_2MHCH3CN,102.06807956,GWYFCOCPABKNJV,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,0,6.0 4059,4510,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWYFCOCPABKNJV-UHFFFAOYSA-N,"InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)",CC(C)CC(=O)O,C5H10O2,pos_2MHCH3CN,102.06807956,GWYFCOCPABKNJV,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Valeriana celtica,21455.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana celtica'],6,0,6.0 4060,4510,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NQPDZGIKBAWPEJ-UHFFFAOYSA-N,"InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)",CCCCC(=O)O,C5H10O2,pos_2MHCH3CN,102.06807956,NQPDZGIKBAWPEJ,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,0,6.0 4061,4510,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NQPDZGIKBAWPEJ-UHFFFAOYSA-N,"InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)",CCCCC(=O)O,C5H10O2,pos_2MHCH3CN,102.06807956,NQPDZGIKBAWPEJ,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4062,4509,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.0,MS1_match,BOQRGNNIHUELJI-CZUORRHYSA-N,"InChI=1S/C17H18O7/c1-22-14-5-9(18)6-15-10(14)7-13(21)16(24-15)8-3-11(19)17(23-2)12(20)4-8/h3-6,13,16,18-21H,7H2,1-2H3/t13-,16-/m1/s1",COc1cc(O)cc2c1C[C@@H](O)[C@@H](c1cc(O)c(OC)c(O)c1)O2,C17H18O7,pos_1_1proton1ammonium,334.105252916,BOQRGNNIHUELJI,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,3,7.5 4063,4508,1351,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.37883952,ISDB,FJCQUJKUMKZEMH-UHFFFAOYSA-N,"InChI=1S/C14H22O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h7,10H,5-6,8-9H2,1-4H3",CC(C=O)=CCC1=C(C)CCCC1(C)C,C14H22O,,206.167065324,FJCQUJKUMKZEMH,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,9.015358090400696 4064,4505,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_2MNa,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 4065,4505,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_2MNa,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4066,4504,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.3614219,ISDB,,,,,,,MBBOPONQLZPJRT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4456876516342163 4067,4502,-1,,,,0.55450886,ISDB,DDCXFQXXQUYLQV-LFDWGOBLSA-N,"InChI=1S/C30H44O2/c1-18(2)9-7-10-19(3)23-14-22-16-30(25(23)13-21(22)5)26-15-24-20(4)11-8-12-29(24,6)17-27(26)32-28(30)31/h9,13,19,22-27H,4,7-8,10-12,14-17H2,1-3,5-6H3/t19-,22+,23-,24+,25-,26-,27+,29+,30-/m0/s1",C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@]4(C[C@H]5C[C@@H]([C@@H](C)CCC=C(C)C)[C@@H]4C=C5C)[C@H]3C[C@H]12,C30H44O2,,436.334130648,DDCXFQXXQUYLQV,Terpenoids,,,Helenium autumnale,483908.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Helenium'],['Helenium autumnale'],4,0,6.218035459518433 4068,4501,-1,,,,0.6473453,ISDB,MAGPJVVGBCSWPF-HNNXBMFYSA-N,"InChI=1S/C20H23NO5/c1-24-17-9-13-12(18(23)20(17)26-3)6-7-21-10-14-11(8-15(13)21)4-5-16(22)19(14)25-2/h4-5,9,15,22-23H,6-8,10H2,1-3H3/t15-/m0/s1",COc1cc2c(c(O)c1OC)CCN1Cc3c(ccc(O)c3OC)C[C@@H]21,C20H23NO5,,357.157622836,MAGPJVVGBCSWPF,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Polyalthia stenopetala,727643.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Polyalthia'],['Polyalthia stenopetala'],4,0,6.589381217956543 4069,4501,-1,,,,0.6473453,ISDB,MAGPJVVGBCSWPF-HNNXBMFYSA-N,"InChI=1S/C20H23NO5/c1-24-17-9-13-12(18(23)20(17)26-3)6-7-21-10-14-11(8-15(13)21)4-5-16(22)19(14)25-2/h4-5,9,15,22-23H,6-8,10H2,1-3H3/t15-/m0/s1",COc1cc2c(c(O)c1OC)CCN1Cc3c(ccc(O)c3OC)C[C@@H]21,C20H23NO5,,357.157622836,MAGPJVVGBCSWPF,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Fissistigma balansae,3868674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Fissistigma'],['Fissistigma balansae'],4,0,6.589381217956543 4070,4500,-1,,,,0.0,MS1_match,FILRFEXGRQEKMM-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)14(7)23-5-8(6)18)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_sodium,362.157682412,FILRFEXGRQEKMM,Terpenoids,Monoterpenoids,,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 4071,4500,-1,,,,0.0,MS1_match,DPBCFTHDJGXWRI-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(19)16(2,14(7)23-5-8(6)18)25-15-13(22)12(21)11(20)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_sodium,362.157682412,DPBCFTHDJGXWRI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 4072,4500,-1,,,,0.0,MS1_match,DBLVGADGVDUSHJ-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_sodium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 4073,4500,-1,,,,0.0,MS1_match,DBLVGADGVDUSHJ-RLIMOHGTSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7+,8-,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_sodium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 4074,4500,-1,,,,0.0,MS1_match,RAKWYUWXLTYDQR-LTPIHACHSA-N,"InChI=1S/C16H26O9/c1-6-7-2-10(8(3-17)9(7)5-23-15(6)22)24-16-14(21)13(20)12(19)11(4-18)25-16/h6-14,16-21H,2-5H2,1H3/t6-,7-,8-,9+,10+,11-,12-,13+,14-,16-/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]21,C16H26O9,pos_1_sodium,362.157682412,RAKWYUWXLTYDQR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 4075,4500,-1,,,,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_sodium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 4076,4500,-1,,,,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_sodium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 4077,4499,-1,,,,0.0,MS1_match,AFSDNFLWKVMVRB-UHFFFAOYSA-N,"InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H",O=c1oc2c(O)c(O)cc3c(=O)oc4c(O)c(O)cc1c4c23,C14H6O8,pos_1_1proton1isopropanol,302.006267152,AFSDNFLWKVMVRB,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Gallotannins,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4078,4497,281,,,,0.22866964,ISDB,,,,,,,KBWVUHRNDGZVAA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9146785736083984 4079,4496,9,Terpenoids,Fatty acyls,Fatty aldehydes,0.5613203,ISDB,RDQSIADLBQFVMY-UHFFFAOYSA-N,"InChI=1S/C14H20O2/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8H,1-6H3",CC(C)(C)C1=CC(=O)C=C(C(C)(C)C)C1=O,C14H20O2,,220.14632988,RDQSIADLBQFVMY,Terpenoids,,,Leptolyngbya tenuis,447081.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Leptolyngbya'],['Leptolyngbya tenuis'],0,1,2.745281219482422 4080,4496,9,Terpenoids,Fatty acyls,Fatty aldehydes,0.5613203,ISDB,RDQSIADLBQFVMY-UHFFFAOYSA-N,"InChI=1S/C14H20O2/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8H,1-6H3",CC(C)(C)C1=CC(=O)C=C(C(C)(C)C)C1=O,C14H20O2,,220.14632988,RDQSIADLBQFVMY,Terpenoids,,,Phormidium tenue,894826.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Phormidium'],['Phormidium tenue'],0,1,2.745281219482422 4081,4492,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1methanol,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 4082,4492,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,BGWXCNUGXLABMC-UHFFFAOYSA-N,"InChI=1S/C10H12O4/c1-4-5-3-6(11)10(2)7(5)8(12)13-9(4)14-10/h5-7,9,11H,1,3H2,2H3",C=C1C2OC(=O)C3C1CC(O)C3(C)O2,C10H12O4,pos_1_1proton,196.073558864,BGWXCNUGXLABMC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 4083,4491,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5737105,ISDB,UNULJZGBTGCCHL-WAJDCHDJSA-N,"InChI=1S/C29H46O/c1-25(2)14-10-19-11-16-28(6)21(20(19)18-25)8-9-23-27(5)15-13-24(30)26(3,4)22(27)12-17-29(23,28)7/h8,22-24,30H,9-18H2,1-7H3/t22-,23+,24-,27-,28+,29+/m0/s1",CC1(C)CCC2=C(C1)C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2,C29H46O,,410.3548660919999,UNULJZGBTGCCHL,Terpenoids,Triterpenoids,Oleanane triterpenoids,Aegiceras corniculatum,519879.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Aegiceras'],['Aegiceras corniculatum'],4,3,7.794842004776001 4084,4486,767,Alkaloids,Lignans,3-Spirotetramic acids,0.23824424,ISDB,UWQKMPYEPLVKBC-UHFFFAOYSA-N,"InChI=1S/C16H23NO6/c1-10(22-4)16(21,15(2,3)20)14(19)23-9-11-5-7-17-8-6-12(18)13(11)17/h5,7,10,20-21H,6,8-9H2,1-4H3",COC(C)C(O)(C(=O)OCc1ccn2c1C(=O)CC2)C(C)(C)O,C16H23NO6,,325.152537456,UWQKMPYEPLVKBC,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Heliotropium bovei,6063691.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Heliotropiaceae'],['Unknown'],['Heliotropium'],['Heliotropium bovei'],4,1,5.452976942062378 4085,4484,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.39106685,ISDB,OISFHODBOQNZAG-IAGOWNOFSA-N,"InChI=1S/C18H36O5/c19-15-11-7-2-1-4-8-12-16(20)17(21)13-9-5-3-6-10-14-18(22)23/h16-17,19-21H,1-15H2,(H,22,23)/t16-,17-/m1/s1",O=C(O)CCCCCCC[C@@H](O)[C@H](O)CCCCCCCCO,C18H36O5,,332.256274252,OISFHODBOQNZAG,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Salvia,374096.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Unknown'],4,2,6.56426739692688 4086,4484,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.39106685,ISDB,OISFHODBOQNZAG-UHFFFAOYSA-N,"InChI=1S/C18H36O5/c19-15-11-7-2-1-4-8-12-16(20)17(21)13-9-5-3-6-10-14-18(22)23/h16-17,19-21H,1-15H2,(H,22,23)",O=C(O)CCCCCCCC(O)C(O)CCCCCCCCO,C18H36O5,,332.2562742519999,OISFHODBOQNZAG,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Rosmarinus officinalis,778824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia rosmarinus'],4,2,6.56426739692688 4087,4484,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.39106685,ISDB,OISFHODBOQNZAG-UHFFFAOYSA-N,"InChI=1S/C18H36O5/c19-15-11-7-2-1-4-8-12-16(20)17(21)13-9-5-3-6-10-14-18(22)23/h16-17,19-21H,1-15H2,(H,22,23)",O=C(O)CCCCCCCC(O)C(O)CCCCCCCCO,C18H36O5,,332.2562742519999,OISFHODBOQNZAG,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Triticum aestivum,31926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Triticum'],['Triticum aestivum'],4,2,6.56426739692688 4088,4484,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.39106685,ISDB,OISFHODBOQNZAG-UHFFFAOYSA-N,"InChI=1S/C18H36O5/c19-15-11-7-2-1-4-8-12-16(20)17(21)13-9-5-3-6-10-14-18(22)23/h16-17,19-21H,1-15H2,(H,22,23)",O=C(O)CCCCCCCC(O)C(O)CCCCCCCCO,C18H36O5,,332.2562742519999,OISFHODBOQNZAG,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Clivia miniata,512516.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Clivia'],['Clivia miniata'],4,2,6.56426739692688 4089,4483,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,CTNJQMRGPONFBS-DENIDVDHSA-N,"InChI=1S/C21H28O6/c1-6-17(14-27-20(22)12-15(2)3)21(23)26-11-7-8-16-9-10-18(24-4)19(13-16)25-5/h6-10,13,15H,11-12,14H2,1-5H3/b8-7+,17-6-",C/C=C(/COC(=O)CC(C)C)C(=O)OC/C=C/c1ccc(OC)c(OC)c1,C21H28O6,pos_1_1proton1isopropanol,376.188588616,CTNJQMRGPONFBS,Fatty acids,Fatty esters,Wax monoesters,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 4090,4482,-1,,,,0.0,MS1_match,CRZQGDNQQAALAY-UHFFFAOYSA-N,"InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3",COC(=O)Cc1ccccc1,C9H10O2,pos_1_1proton1methanol,150.06807956,CRZQGDNQQAALAY,Shikimates and Phenylpropanoids,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4091,4481,-1,,,,0.21268591,ISDB,VSDQPXFTDJVJID-QQDLLWOVSA-N,"InChI=1S/C21H29NO8/c1-13-11-15(7-10-28-14(2)23)19(25)30-17-6-9-22(4)8-5-16(18(17)24)12-29-20(26)21(13,3)27/h5,7,13,17,27H,6,8-12H2,1-4H3/b15-7+,16-5-/t13-,17+,21+/m0/s1",CC(=O)OC/C=C1\C[C@H](C)[C@@](C)(O)C(=O)OC/C2=C/CN(C)CC[C@@H](OC1=O)C2=O,C21H29NO8,,423.189316888,VSDQPXFTDJVJID,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Packera anonyma,597460.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Packera'],['Packera anonyma'],4,0,4.850743651390076 4092,4478,-1,,,,0.0,MS1_match,JLCCCJIGHPZGMX-LGKXIHMKSA-N,"InChI=1S/C65H106O32/c1-24-11-16-65(59(84)97-56-46(81)42(77)39(74)31(92-56)23-87-53-44(79)40(75)37(72)28(19-66)89-53)18-17-62(6)26(52(65)64(24,8)85)9-10-33-61(5)14-13-34(60(3,4)32(61)12-15-63(33,62)7)93-58-51(36(71)27(69)22-86-58)96-57-48(83)50(35(70)25(2)88-57)95-55-47(82)43(78)49(30(21-68)91-55)94-54-45(80)41(76)38(73)29(20-67)90-54/h9,24-25,27-58,66-83,85H,10-23H2,1-8H3/t24-,25+,27-,28-,29-,30-,31-,32+,33-,34+,35+,36-,37-,38-,39-,40+,41+,42+,43-,44-,45-,46-,47-,48-,49-,50-,51+,52-,53-,54+,55+,56+,57+,58+,61+,62-,63-,64-,65+/m1/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@H]7[C@](C(=O)O[C@@H]8O[C@H](CO[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](O)[C@H](O)[C@H]8O)(CC[C@@H](C)[C@@]7(C)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@@H](O)[C@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H]1O,C65H106O32,pos_2_2sodium,1398.6667212319996,JLCCCJIGHPZGMX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,0,6.0 4093,4478,-1,,,,0.0,MS1_match,JLCCCJIGHPZGMX-LGKXIHMKSA-N,"InChI=1S/C65H106O32/c1-24-11-16-65(59(84)97-56-46(81)42(77)39(74)31(92-56)23-87-53-44(79)40(75)37(72)28(19-66)89-53)18-17-62(6)26(52(65)64(24,8)85)9-10-33-61(5)14-13-34(60(3,4)32(61)12-15-63(33,62)7)93-58-51(36(71)27(69)22-86-58)96-57-48(83)50(35(70)25(2)88-57)95-55-47(82)43(78)49(30(21-68)91-55)94-54-45(80)41(76)38(73)29(20-67)90-54/h9,24-25,27-58,66-83,85H,10-23H2,1-8H3/t24-,25+,27-,28-,29-,30-,31-,32+,33-,34+,35+,36-,37-,38-,39-,40+,41+,42+,43-,44-,45-,46-,47-,48-,49-,50-,51+,52-,53-,54+,55+,56+,57+,58+,61+,62-,63-,64-,65+/m1/s1",C[C@@H]1O[C@@H](O[C@@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@H]7[C@](C(=O)O[C@@H]8O[C@H](CO[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](O)[C@H](O)[C@H]8O)(CC[C@@H](C)[C@@]7(C)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@@H](O)[C@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H]1O,C65H106O32,pos_2_2sodium,1398.6667212319996,JLCCCJIGHPZGMX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Scabiosa tschiliensis,589183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa tschiliensis'],6,0,6.0 4094,4476,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.21156958,ISDB,OUCNJXKGEGGTTI-UHFFFAOYSA-N,"InChI=1S/C23H24O4/c1-26-21-14-18(9-6-16-4-3-5-20(25)12-16)22(23(15-21)27-2)13-17-7-10-19(24)11-8-17/h3-5,7-8,10-12,14-15,24-25H,6,9,13H2,1-2H3",COc1cc(CCc2cccc(O)c2)c(Cc2ccc(O)cc2)c(OC)c1,C23H24O4,,364.167459248,OUCNJXKGEGGTTI,Shikimates and Phenylpropanoids,Stilbenoids,Monomeric stilbenes,Bletilla ochracea,88911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Arethuseae'],['Bletilla'],['Bletilla ochracea'],4,0,4.8462783098220825 4095,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-URVUXULASA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20+,22+/m1/s1",COc1cc2c(cc1OC)[C@@H]1O[C@H](O)c3c(ccc(OC)c3OC)[C@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver bracteatum,237538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver bracteatum'],4,0,6.738542556762695 4096,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-URVUXULASA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20+,22+/m1/s1",COc1cc2c(cc1OC)[C@@H]1O[C@H](O)c3c(ccc(OC)c3OC)[C@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver nudicaule,784404.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver nudicaule'],4,0,6.738542556762695 4097,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-URVUXULASA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20+,22+/m1/s1",COc1cc2c(cc1OC)[C@@H]1O[C@H](O)c3c(ccc(OC)c3OC)[C@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver kerneri,7591121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver kerneri'],4,0,6.738542556762695 4098,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-URVUXULASA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20+,22+/m1/s1",COc1cc2c(cc1OC)[C@@H]1O[C@H](O)c3c(ccc(OC)c3OC)[C@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver orientale,171970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver orientale'],4,0,6.738542556762695 4099,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-UHFFFAOYSA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3",COc1cc2c(cc1OC)C1OC(O)c3c(ccc(OC)c3OC)C1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver setiferum,237513.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver pseudo-orientale'],4,0,6.738542556762695 4100,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-JAXLGGSGSA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20-,22+/m0/s1",COc1cc2c(cc1OC)[C@@H]1O[C@@H](O)c3c(ccc(OC)c3OC)[C@@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver tatricum,740024.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver tatricum'],4,0,6.738542556762695 4101,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-JAXLGGSGSA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20-,22+/m0/s1",COc1cc2c(cc1OC)[C@@H]1O[C@@H](O)c3c(ccc(OC)c3OC)[C@@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver pygmaeum,3944896.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver pygmaeum'],4,0,6.738542556762695 4102,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-JAXLGGSGSA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20-,22+/m0/s1",COc1cc2c(cc1OC)[C@@H]1O[C@@H](O)c3c(ccc(OC)c3OC)[C@@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver alpinum,740031.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver alpinum'],4,0,6.738542556762695 4103,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-RZUBCFFCSA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20+,22-/m1/s1",COc1cc2c(cc1OC)[C@@H]1O[C@@H](O)c3c(ccc(OC)c3OC)[C@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver armeniacum,605764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver armeniacum'],4,0,6.738542556762695 4104,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-RZUBCFFCSA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20+,22-/m1/s1",COc1cc2c(cc1OC)[C@@H]1O[C@@H](O)c3c(ccc(OC)c3OC)[C@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver fugax,6130809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver fugax'],4,0,6.738542556762695 4105,4469,-1,,,,0.68463564,ISDB,CJYNYVSDQZLRSG-RZUBCFFCSA-N,"InChI=1S/C22H27NO6/c1-23-9-8-12-10-16(26-3)17(27-4)11-14(12)20-19(23)13-6-7-15(25-2)21(28-5)18(13)22(24)29-20/h6-7,10-11,19-20,22,24H,8-9H2,1-5H3/t19-,20+,22-/m1/s1",COc1cc2c(cc1OC)[C@@H]1O[C@@H](O)c3c(ccc(OC)c3OC)[C@H]1N(C)CC2,C22H27NO6,,401.183837584,CJYNYVSDQZLRSG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver macrostomum,84036.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver macrostomum'],4,0,6.738542556762695 4106,4467,281,,,,0.20833358,ISDB,,,,,,,LLZPQHOZAQNDCM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8333343267440796 4107,4463,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.38385373,ISDB,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,8.535414934158325 4108,4463,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.38385373,ISDB,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.535414934158325 4109,4463,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.38385373,ISDB,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,2,8.535414934158325 4110,4461,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.45567945,ISDB,MYQAIYGVAHDZRD-JUIQTESCSA-N,"InChI=1S/C29H44O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-11,13,19-21,23,25,27,30H,7,12,14-18H2,1-6H3/b9-8+/t20-,21-,23+,25-,27+,28+,29-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CC=C2C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(C)C,C29H44O,,408.339216028,MYQAIYGVAHDZRD,Terpenoids,Steroids,Ergostane steroids,Actinidia chinensis var. deliciosa,279986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Actinidiaceae'],['Unknown'],['Actinidia'],['Actinidia deliciosa'],4,1,6.322717785835266 4111,4460,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.43691814,ISDB,FMIMFCRXYXVFTA-FUAOEXFOSA-N,"InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-22H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O3,,454.344695332,FMIMFCRXYXVFTA,Terpenoids,Triterpenoids,Oleanane triterpenoids,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,3,10.24767255783081 4112,4459,-1,,,,0.0,MS1_match,SFLJKERWIWKVDG-TVAJMVSCSA-N,"InChI=1S/C16H26O10/c1-15(22)7-5-24-14(21)16(2,23)6(7)3-9(15)26-13-12(20)11(19)10(18)8(4-17)25-13/h6-13,17-20,22-23H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15-,16-/m0/s1",C[C@@]1(O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@H]2[C@@H]1COC(=O)[C@@]2(C)O,C16H26O10,pos_1_1proton1ammonium,378.152597032,SFLJKERWIWKVDG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 4113,4458,314,Terpenoids,Monoterpenoids,Lactones,0.0,MS1_match,FKUPPRZPSYCDRS-UHFFFAOYSA-N,InChI=1S/C15H28O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h1-14H2,O=C1CCCCCCCCCCCCCCO1,C15H28O2,pos_1_1proton,240.208930136,FKUPPRZPSYCDRS,Fatty acids,Fatty esters,Lactones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4114,4456,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_2MHNH3,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 4115,4456,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_2MHNH3,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,2,8.0 4116,4454,-1,,,,0.52407026,ISDB,,,,,,,PEQAFOAATUJIMD,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.096281051635742 4117,4452,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.31757063,ISDB,JSXCGBWUPLORSN-UHFFFAOYSA-N,"InChI=1S/C35H54O7/c1-19-25-20-8-9-23-31(4)12-11-24(41-28-27(38)26(37)21(36)18-40-28)30(2,3)22(31)10-13-33(23,6)32(20,5)14-16-35(25)17-15-34(19,7)42-29(35)39/h8,19,21-28,36-38H,9-18H2,1-7H3",CC1C2C3=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CCC23CCC1(C)OC3=O,C35H54O7,,586.3869540679999,JSXCGBWUPLORSN,Terpenoids,Triterpenoids,Oleanane triterpenoids,Rosa laevigata,383273.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa laevigata'],4,3,6.770282506942749 4118,4451,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.48292708,ISDB,UZNKGMPIZWBDHA-UHFFFAOYSA-N,"InChI=1S/C19H17NO4/c1-22-14-6-4-12(5-7-14)19(21)18-15-11-17(24-3)16(23-2)10-13(15)8-9-20-18/h4-11H,1-3H3",COc1ccc(C(=O)c2nccc3cc(OC)c(OC)cc23)cc1,C19H17NO4,,323.115758024,UZNKGMPIZWBDHA,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Beilschmiedia penangiana,6025418.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Beilschmiedia'],['Beilschmiedia penangiana'],4,3,7.431708335876465 4119,4449,543,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,MNTMKESYFRNNRE-SDXTZGNSSA-N,"InChI=1S/C53H86O23/c1-48(2)13-15-53(47(68)76-45-41(67)38(64)35(61)28(73-45)21-70-43-39(65)36(62)33(59)26(18-54)71-43)16-14-51(5)23(24(53)17-48)7-8-30-49(3)11-10-31(50(4,22-56)29(49)9-12-52(30,51)6)74-46-42(32(58)25(57)20-69-46)75-44-40(66)37(63)34(60)27(19-55)72-44/h7,24-46,54-67H,8-22H2,1-6H3/t24-,25+,26+,27+,28+,29+,30+,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,42-,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C53H86O23,pos_1_sodium,1090.555989012,MNTMKESYFRNNRE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4120,4449,543,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,MNTMKESYFRNNRE-SDXTZGNSSA-N,"InChI=1S/C53H86O23/c1-48(2)13-15-53(47(68)76-45-41(67)38(64)35(61)28(73-45)21-70-43-39(65)36(62)33(59)26(18-54)71-43)16-14-51(5)23(24(53)17-48)7-8-30-49(3)11-10-31(50(4,22-56)29(49)9-12-52(30,51)6)74-46-42(32(58)25(57)20-69-46)75-44-40(66)37(63)34(60)27(19-55)72-44/h7,24-46,54-67H,8-22H2,1-6H3/t24-,25+,26+,27+,28+,29+,30+,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,42-,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C53H86O23,pos_1_sodium,1090.555989012,MNTMKESYFRNNRE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4121,4448,312,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,CRSFLLTWRCYNNX-QBNNUVSCSA-N,"InChI=1S/C16H18O10/c1-23-7-4-6-2-3-9(18)25-14(6)15(11(7)20)26-16-13(22)12(21)10(19)8(5-17)24-16/h2-4,8,10,12-13,16-17,19-22H,5H2,1H3/t8-,10-,12+,13-,16+/m1/s1",COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O,C16H18O10,pos_1_1proton1acetonitrile,370.0899967759999,CRSFLLTWRCYNNX,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4122,4448,312,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,CRSFLLTWRCYNNX-QBNNUVSCSA-N,"InChI=1S/C16H18O10/c1-23-7-4-6-2-3-9(18)25-14(6)15(11(7)20)26-16-13(22)12(21)10(19)8(5-17)24-16/h2-4,8,10,12-13,16-17,19-22H,5H2,1H3/t8-,10-,12+,13-,16+/m1/s1",COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O,C16H18O10,pos_1_1proton1acetonitrile,370.0899967759999,CRSFLLTWRCYNNX,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4123,4445,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.59367704,ISDB,,,,,,,QAHGWBXHJADPOM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.3747081756591797 4124,4443,-1,,,,0.0,MS1_match,BEGPRDHBWMCZLC-XYLSPBENSA-N,"InChI=1S/C15H24O2/c1-13(2)9-5-7-14(3)10(16)6-8-15(4,17)12(14)11(9)13/h9,11-12,17H,5-8H2,1-4H3/t9?,11?,12?,14-,15+/m1/s1",CC1(C)C2CC[C@]3(C)C(=O)CC[C@](C)(O)C3C21,C15H24O2,pos_2MH,236.177630008,BEGPRDHBWMCZLC,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4125,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-NQDNWIIDSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21-,22-,23-,26+,27-,28-,29-,30-/m1/s1",CC1(C)CC[C@@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria transsylvanica,3892197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria transsylvanica'],6,0,6.0 4126,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus azureus,6061231.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus azureus'],6,0,6.0 4127,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus dipsacoides,6061231.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus azureus'],6,0,6.0 4128,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 4129,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria paphlagonica,977921.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria paphlagonica'],6,0,6.0 4130,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 4131,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 4132,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lomelosia olivieri,5746458.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olivieri'],6,0,6.0 4133,4443,-1,,,,0.0,MS1_match,HFGSQOYIOKBQOW-UHFFFAOYSA-N,"InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)",CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C2C1C,C30H48O4,pos_1_1proton,472.3552600159999,HFGSQOYIOKBQOW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4134,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 4135,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus azureus,6061231.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus azureus'],6,0,6.0 4136,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus dipsacoides,6061231.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus azureus'],6,0,6.0 4137,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 4138,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria paphlagonica,977921.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria paphlagonica'],6,0,6.0 4139,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 4140,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 4141,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lomelosia olivieri,5746458.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olivieri'],6,0,6.0 4142,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 4143,4443,-1,,,,0.0,MS1_match,PGOYMURMZNDHNS-NQDNWIIDSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21-,22-,23-,26+,27-,28-,29-,30-/m1/s1",CC1(C)CC[C@@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria transsylvanica,3892197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria transsylvanica'],6,0,6.0 4144,4443,-1,,,,0.0,MS1_match,NZCULBURCGAPSF-PQWKYGPVSA-N,"InChI=1S/C30H48O4/c1-18-9-14-30(25(33)34)16-15-28(5)20(24(30)19(18)2)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h7,18-19,21-24,31-32H,8-17H2,1-6H3,(H,33,34)/t18-,19+,21-,22-,23+,24+,26+,27+,28-,29-,30+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@H]12,C30H48O4,pos_1_1proton,472.3552600159999,NZCULBURCGAPSF,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 4145,4443,-1,,,,0.0,MS1_match,HFGSQOYIOKBQOW-ZSDYHTTISA-N,"InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C30H48O4,pos_1_1proton,472.3552600159999,HFGSQOYIOKBQOW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 4146,4443,-1,,,,0.0,MS1_match,HFGSQOYIOKBQOW-ZSDYHTTISA-N,"InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C30H48O4,pos_1_1proton,472.3552600159999,HFGSQOYIOKBQOW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 4147,4443,-1,,,,0.0,MS1_match,BEGPRDHBWMCZLC-XYLSPBENSA-N,"InChI=1S/C15H24O2/c1-13(2)9-5-7-14(3)10(16)6-8-15(4,17)12(14)11(9)13/h9,11-12,17H,5-8H2,1-4H3/t9?,11?,12?,14-,15+/m1/s1",CC1(C)C2CC[C@]3(C)C(=O)CC[C@](C)(O)C3C21,C15H24O2,pos_2MH,236.177630008,BEGPRDHBWMCZLC,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 4148,4443,-1,,,,0.0,MS1_match,ZJIVEFDADFTLMI-ULWTYWRYSA-N,"InChI=1S/C15H24O2/c1-8-5-9(16)6-10-12(17)7-11-13(14(11,2)3)15(8,10)4/h6,8-9,11-13,16-17H,5,7H2,1-4H3/t8-,9-,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2[C@@H](O)C[C@@H]3[C@@H](C3(C)C)[C@]21C,C15H24O2,pos_2MH,236.177630008,ZJIVEFDADFTLMI,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 4149,4443,-1,,,,0.0,MS1_match,DHOMMAYDBREASS-MRLBHPIUSA-N,"InChI=1S/C15H24O2/c1-9(2)15-8-5-10(3)11-6-7-14(4,16)12(11)13(15)17-15/h9,11-13,16H,3,5-8H2,1-2,4H3/t11-,12-,13+,14+,15+/m1/s1",C=C1CC[C@@]2(C(C)C)O[C@H]2[C@H]2[C@@H]1CC[C@]2(C)O,C15H24O2,pos_2MH,236.177630008,DHOMMAYDBREASS,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4150,4443,-1,,,,0.0,MS1_match,TVGPYTOYKLZBPA-UHFFFAOYSA-N,"InChI=1S/C15H24O2/c1-10(2)7-14(16)17-9-11-5-6-12-8-13(11)15(12,3)4/h5,10,12-13H,6-9H2,1-4H3",CC(C)CC(=O)OCC1=CCC2CC1C2(C)C,C15H24O2,pos_2MH,236.177630008,TVGPYTOYKLZBPA,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4151,4443,-1,,,,0.0,MS1_match,HFGSQOYIOKBQOW-UHFFFAOYSA-N,"InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)",CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C2C1C,C30H48O4,pos_1_1proton,472.3552600159999,HFGSQOYIOKBQOW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4152,4443,-1,,,,0.0,MS1_match,NZCULBURCGAPSF-PQWKYGPVSA-N,"InChI=1S/C30H48O4/c1-18-9-14-30(25(33)34)16-15-28(5)20(24(30)19(18)2)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h7,18-19,21-24,31-32H,8-17H2,1-6H3,(H,33,34)/t18-,19+,21-,22-,23+,24+,26+,27+,28-,29-,30+/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@H]12,C30H48O4,pos_1_1proton,472.3552600159999,NZCULBURCGAPSF,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 4153,4443,-1,,,,0.0,MS1_match,XLZVKKAUANEKGL-UQXKVLDMSA-N,"InChI=1S/C15H24O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-11,17H,5-8H2,1-4H3/t9-,10-,11-,14-,15+/m0/s1",C[C@H]1CC[C@@]2(O)C(C)(C)[C@H]3C[C@@H]1[C@]2(C)CC3=O,C15H24O2,pos_2MH,236.177630008,XLZVKKAUANEKGL,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4154,4443,-1,,,,0.0,MS1_match,ZZTYPLSBNNGEIS-OPAXANQDSA-N,"InChI=1S/C30H48O4/c1-18-10-15-30(24(32)33)17-16-27(5)19(23(30)29(18,7)34)8-9-21-26(4)13-12-22(31)25(2,3)20(26)11-14-28(21,27)6/h8,18,20-23,31,34H,9-17H2,1-7H3,(H,32,33)/t18-,20+,21-,22+,23-,26+,27-,28-,29-,30+/m1/s1",C[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2[C@]1(C)O,C30H48O4,pos_1_1proton,472.355260016,ZZTYPLSBNNGEIS,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4155,4443,-1,,,,0.0,MS1_match,ZZTYPLSBNNGEIS-OPAXANQDSA-N,"InChI=1S/C30H48O4/c1-18-10-15-30(24(32)33)17-16-27(5)19(23(30)29(18,7)34)8-9-21-26(4)13-12-22(31)25(2,3)20(26)11-14-28(21,27)6/h8,18,20-23,31,34H,9-17H2,1-7H3,(H,32,33)/t18-,20+,21-,22+,23-,26+,27-,28-,29-,30+/m1/s1",C[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2[C@]1(C)O,C30H48O4,pos_1_1proton,472.355260016,ZZTYPLSBNNGEIS,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4156,4443,-1,,,,0.0,MS1_match,ZZTYPLSBNNGEIS-OPAXANQDSA-N,"InChI=1S/C30H48O4/c1-18-10-15-30(24(32)33)17-16-27(5)19(23(30)29(18,7)34)8-9-21-26(4)13-12-22(31)25(2,3)20(26)11-14-28(21,27)6/h8,18,20-23,31,34H,9-17H2,1-7H3,(H,32,33)/t18-,20+,21-,22+,23-,26+,27-,28-,29-,30+/m1/s1",C[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2[C@]1(C)O,C30H48O4,pos_1_1proton,472.355260016,ZZTYPLSBNNGEIS,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4157,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Semiarundinaria fastuosa,502615.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Arundinarieae'],['Semiarundinaria'],['Semiarundinaria fastuosa'],4,3,6.467058300971985 4158,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Talipariti tiliaceum,120948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Talipariti'],['Talipariti tiliaceum'],4,3,6.467058300971985 4159,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Quercus pyrenaica,716878.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Quercus'],['Quercus pyrenaica'],4,3,6.467058300971985 4160,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hibiscus taiwanensis,6117615.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Hibiscus'],['Hibiscus taiwanensis'],4,3,6.467058300971985 4161,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Populus euphratica,164191.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Saliceae'],['Populus'],['Populus euphratica'],4,3,6.467058300971985 4162,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Senna,404633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Senna'],['Unknown'],4,3,6.467058300971985 4163,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Zanthoxylum ailanthoides,806818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum ailanthoides'],4,3,6.467058300971985 4164,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Duhaldea cappa,182175.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Duhaldea'],['Duhaldea cappa'],4,3,6.467058300971985 4165,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Phyllostachys edulis,256629.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Arundinarieae'],['Phyllostachys'],['Phyllostachys edulis'],4,3,6.467058300971985 4166,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Senra incana,6118678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Senra'],['Senra incana'],4,3,6.467058300971985 4167,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Mikania microptera,7604049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Mikania'],['Mikania microptera'],4,3,6.467058300971985 4168,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Ilex rotunda,1015268.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Aquifoliales'],['Aquifoliaceae'],['Unknown'],['Ilex'],['Ilex rotunda'],4,3,6.467058300971985 4169,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Aeschynanthus bracteatus,154188.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Gesneriaceae'],['Trichosporeae'],['Aeschynanthus'],['Aeschynanthus bracteatus'],4,3,6.467058300971985 4170,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Quercus faginea,381049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Quercus'],['Quercus faginea'],4,3,6.467058300971985 4171,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Quercus robur,239659.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Quercus'],['Quercus robur'],4,3,6.467058300971985 4172,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Machilus zuihoensis,36198.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Machilus'],['Machilus zuihoensis'],4,3,6.467058300971985 4173,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Quercus petraea,516540.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Quercus'],['Quercus petraea'],4,3,6.467058300971985 4174,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hibiscus cannabinus,393745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Hibiscus'],['Hibiscus cannabinus'],4,3,6.467058300971985 4175,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Saussurea macrota,733905.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Himalaiella'],['Himalaiella auriculata'],4,3,6.467058300971985 4176,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Aralia bipinnata,553970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Aralia'],['Aralia bipinnata'],4,3,6.467058300971985 4177,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Wikstroemia canescens,444200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Wikstroemia'],['Wikstroemia canescens'],4,3,6.467058300971985 4178,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Stereospermum colais,313512.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Unknown'],['Stereospermum'],['Stereospermum colais'],4,3,6.467058300971985 4179,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Drypetes littoralis,281151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Putranjivaceae'],['Unknown'],['Drypetes'],['Drypetes littoralis'],4,3,6.467058300971985 4180,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Tarenna attenuata,3878828.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Pavetteae'],['Tarenna'],['Tarenna attenuata'],4,3,6.467058300971985 4181,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Stereospermum tetragonum,5265170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Unknown'],['Stereospermum'],['Stereospermum tetragonum'],4,3,6.467058300971985 4182,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Daphne feddei,5747011.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Daphne'],['Daphne feddei'],4,3,6.467058300971985 4183,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Magnolia officinalis,256695.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Magnoliaceae'],['Unknown'],['Magnolia'],['Magnolia officinalis'],4,3,6.467058300971985 4184,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Codonopsis cordifolioidea,3893808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Campanulaceae'],['Unknown'],['Codonopsis'],['Codonopsis cordifolioidea'],4,3,6.467058300971985 4185,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cirsium helenioides,111716.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Cirsium'],['Cirsium helenioides'],4,3,6.467058300971985 4186,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Quercus suber,272709.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Quercus'],['Quercus suber'],4,3,6.467058300971985 4187,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Platycarya strobilacea,264610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Platycarya'],['Platycarya strobilacea'],4,3,6.467058300971985 4188,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3",COc1cc(C=CC=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Zanthoxylum simulans,889927.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum simulans'],4,3,6.467058300971985 4189,4442,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.24176458,ISDB,CDICDSOGTRCHMG-ONEGZZNKSA-N,"InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+",COc1cc(/C=C/C=O)cc(OC)c1O,C11H12O4,,208.073558864,CDICDSOGTRCHMG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cunila,1097484.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Cunila'],['Unknown'],4,3,6.467058300971985 4190,4436,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.3917045,ISDB,,,,,,,XRVICBWHHBPCDB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5668179988861084 4191,4434,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5252538,ISDB,VVUDCWPSEIDKOG-IILZIWPVSA-N,"InChI=1S/C29H44O2/c1-18-17-22-27(5,24(31)23(18)30)14-16-28(6)21-11-12-25(3)19(2)9-8-10-20(25)26(21,4)13-15-29(22,28)7/h8-9,18,20-22,24,31H,2,10-17H2,1,3-7H3/t18-,20-,21-,22+,24-,25-,26+,27-,28-,29-/m1/s1",C=C1C=CC[C@H]2[C@]3(C)CC[C@]4(C)[C@H]5C[C@@H](C)C(=O)[C@@H](O)[C@]5(C)CC[C@]4(C)[C@@H]3CC[C@]12C,C29H44O2,,424.334130648,VVUDCWPSEIDKOG,Terpenoids,Triterpenoids,Friedelane triterpenoids,Acanthothamnus aphyllus,739323.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Acanthothamnus'],['Acanthothamnus aphyllus'],4,2,7.101015090942383 4192,4432,-1,,,,0.50374013,ISDB,NFNNJFPVLGHNPC-PABGKVSNSA-N,"InChI=1S/C25H34O7/c1-6-14(2)20(26)31-19-11-15(3)24(12-17(30-21(24)27)16-8-10-29-13-16)25(28)9-7-18-23(5,32-18)22(19,25)4/h8,10,13-15,17-19,28H,6-7,9,11-12H2,1-5H3/t14-,15-,17-,18-,19-,22-,23-,24+,25-/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1C[C@@H](C)[C@]2(C[C@H](c3ccoc3)OC2=O)[C@@]2(O)CC[C@H]3O[C@@]3(C)[C@@]12C,C25H34O7,,446.230453428,NFNNJFPVLGHNPC,Terpenoids,Diterpenoids,Halimane diterpenoids,Microglossa pyrrhopappa,1008392.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Conyza'],['Conyza pyrrhopappa'],4,0,6.014960527420044 4193,4431,612,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_sodium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 4194,4431,612,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_sodium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 4195,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5 4196,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 4197,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 4198,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 4199,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 4200,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5 4201,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 4202,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 4203,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 4204,4430,486,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton2acetonitrile,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 4205,4429,-1,,,,0.5375891,ISDB,XBTUEUZQDYSZCE-XZUYRWCXSA-N,"InChI=1S/C13H15NO3/c15-10-3-4-14-9-2-1-8-5-12(16)17-13(8,7-9)11(14)6-10/h1-2,5,9-11,15H,3-4,6-7H2/t9-,10+,11-,13+/m1/s1",O=C1C=C2C=C[C@@H]3C[C@@]2(O1)[C@H]1C[C@@H](O)CCN31,C13H15NO3,,233.10519334,XBTUEUZQDYSZCE,Alkaloids,,,Flueggea suffruticosa,351504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Flueggea'],['Flueggea suffruticosa'],4,0,6.150356292724609 4206,4429,-1,,,,0.5375891,ISDB,XBTUEUZQDYSZCE-XZUYRWCXSA-N,"InChI=1S/C13H15NO3/c15-10-3-4-14-9-2-1-8-5-12(16)17-13(8,7-9)11(14)6-10/h1-2,5,9-11,15H,3-4,6-7H2/t9-,10+,11-,13+/m1/s1",O=C1C=C2C=C[C@@H]3C[C@@]2(O1)[C@H]1C[C@@H](O)CCN31,C13H15NO3,,233.10519334,XBTUEUZQDYSZCE,Alkaloids,,,Margaritaria indica,948375.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Margaritaria'],['Margaritaria indica'],4,0,6.150356292724609 4207,4427,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JUJTUEBXXGRSJB-MTAKFWDWSA-N,"InChI=1S/C17H26O9/c1-3-9-10-4-12(22-2)23-6-8(10)7-24-16(9)26-17-15(21)14(20)13(19)11(5-18)25-17/h3,7,9-21H,1,4-6H2,2H3/t9-,10-,11-,12-,13-,14+,15-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2CO[C@@H](OC)C[C@H]21,C17H26O9,pos_1_1proton1ammonium,374.1576824119999,JUJTUEBXXGRSJB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 4208,4426,251,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GJOKUHOJKKOIEW-UHFFFAOYSA-N,"InChI=1S/C12H14O6/c1-7(4-13)12(17)3-11(18-8(2)16)9(5-14)10(12)6-15/h4,6,11,14,17H,1,3,5H2,2H3",C=C(C=O)C1(O)CC(OC(C)=O)C(CO)=C1C=O,C12H14O6,pos_1_1proton2acetonitrile,254.079038168,GJOKUHOJKKOIEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 4209,4425,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,YHPFWEDUGHFFTA-UHFFFAOYSA-N,"InChI=1S/C24H32O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,14,16,18-20,27H,4-5,7-13H2,1-2H3",CC12CCC(=O)CC1CCC1C2CCC2(C)C(c3ccc(=O)oc3)CCC12O,C24H32O4,pos_2_2proton2acetonitrile,384.230059504,YHPFWEDUGHFFTA,Terpenoids,Steroids,Bufadienolides,Helleborus odorus,648059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus odorus'],6,1,6.5 4210,4424,-1,,,,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton1ethylamine,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4211,4424,-1,,,,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton1ethylamine,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4212,4424,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton1ethylamine,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4213,4424,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton1ethylamine,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4214,4424,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton1ethylamine,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4215,4424,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton1ethylamine,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4216,4423,-1,,,,0.0,MS1_match,RECUKUPTGUEGMW-UHFFFAOYSA-N,"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3",Cc1ccc(C(C)C)cc1O,C10H14O,pos_1_1proton,150.104465068,RECUKUPTGUEGMW,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4217,4423,-1,,,,0.0,MS1_match,HKZQJZIFODOLFR-UHFFFAOYSA-N,"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h6H,4-5H2,1-3H3",CC1=CC(=O)C(=C(C)C)CC1,C10H14O,pos_1_1proton,150.104465068,HKZQJZIFODOLFR,Terpenoids,Monoterpenoids,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4218,4422,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.713977,ISDB,IHQUEBHATOOKPN-UHFFFAOYSA-N,"InChI=1S/C14H22/c1-9-7-8-10-5-4-6-11-13(12(9)10)14(11,2)3/h4-5,9-13H,6-8H2,1-3H3",CC1CCC2C=CCC3C(C12)C3(C)C,C14H22,,190.172150704,IHQUEBHATOOKPN,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Cyperus rotundus,338773.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Cyperaceae'],['Cypereae'],['Cyperus'],['Cyperus rotundus'],4,2,7.855907917022705 4219,4422,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.713977,ISDB,IHQUEBHATOOKPN-UHFFFAOYSA-N,"InChI=1S/C14H22/c1-9-7-8-10-5-4-6-11-13(12(9)10)14(11,2)3/h4-5,9-13H,6-8H2,1-3H3",CC1CCC2C=CCC3C(C12)C3(C)C,C14H22,,190.172150704,IHQUEBHATOOKPN,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Clausena excavata,571298.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Clausena'],['Clausena excavata'],4,2,7.855907917022705 4220,4422,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.713977,ISDB,IHQUEBHATOOKPN-UHFFFAOYSA-N,"InChI=1S/C14H22/c1-9-7-8-10-5-4-6-11-13(12(9)10)14(11,2)3/h4-5,9-13H,6-8H2,1-3H3",CC1CCC2C=CCC3C(C12)C3(C)C,C14H22,,190.172150704,IHQUEBHATOOKPN,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Ursinia speciosa,773007.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Ursinia'],['Ursinia speciosa'],4,2,7.855907917022705 4221,4420,-1,,,,0.23221116,ISDB,VVLXCWVSSLFQDS-QWRGUYRKSA-N,"InChI=1S/C14H18N2O6/c15-10(13(19)20)5-6-12(18)16-11(14(21)22)7-8-1-3-9(17)4-2-8/h1-4,10-11,17H,5-7,15H2,(H,16,18)(H,19,20)(H,21,22)/t10-,11-/m0/s1",N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O,C14H18N2O6,,310.11648629599995,VVLXCWVSSLFQDS,Amino acids and Peptides,Small peptides,Dipeptides,Psophocarpus tetragonolobus,116244.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Psophocarpus'],['Psophocarpus tetragonolobus'],4,0,4.928844630718231 4222,4419,-1,,,,0.0,MS1_match,IBWYIXZIEIPGJL-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-7-5-13-10(6-12)8(4-11)2-3-9(7)10/h2,9,11-12H,1,3-6H2",C=C1COC2(CO)C(CO)=CCC12,C10H14O3,pos_2MNa,182.094294308,IBWYIXZIEIPGJL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4223,4419,-1,,,,0.0,MS1_match,ULRBKGCIGBUVLG-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-5-6-3-8(11)10(2)7(6)4-12-9(5)13-10/h6-9,11H,1,3-4H2,2H3",C=C1C2OCC3C1CC(O)C3(C)O2,C10H14O3,pos_2MNa,182.094294308,ULRBKGCIGBUVLG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4224,4418,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.31864962,ISDB,UBQCFEASTTXIKB-UHFFFAOYSA-N,"InChI=1S/C27H28N2O4/c1-20(30)28-24(17-21-11-5-2-6-12-21)19-33-27(32)25(18-22-13-7-3-8-14-22)29-26(31)23-15-9-4-10-16-23/h2-16,24-25H,17-19H2,1H3,(H,28,30)(H,29,31)",CC(=O)NC(COC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1)Cc1ccccc1,C27H28N2O4,,444.204907376,UBQCFEASTTXIKB,Amino acids and Peptides,Small peptides,Dipeptides,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,7.274598479270935 4225,4416,-1,,,,0.38372824,ISDB,DMJYNLHZLIZUQE-YLWLKBPMSA-N,"InChI=1S/C11H13NO4/c1-5-7-4-10(14)9(13)3-6(7)2-8(12-5)11(15)16/h3-5,8,12-14H,2H2,1H3,(H,15,16)/t5-,8+/m0/s1",C[C@@H]1N[C@@H](C(=O)O)Cc2cc(O)c(O)cc21,C11H13NO4,,223.084457896,DMJYNLHZLIZUQE,Alkaloids,Tyrosine alkaloids,,Mucuna pruriens var. utilis,1010064.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Mucuna'],['Mucuna pruriens'],4,0,5.534912943840027 4226,4416,-1,,,,0.38372824,ISDB,DMJYNLHZLIZUQE-XNCJUZBTSA-N,"InChI=1S/C11H13NO4/c1-5-7-4-10(14)9(13)3-6(7)2-8(12-5)11(15)16/h3-5,8,12-14H,2H2,1H3,(H,15,16)/t5-,8-/m0/s1",C[C@@H]1N[C@H](C(=O)O)Cc2cc(O)c(O)cc21,C11H13NO4,,223.084457896,DMJYNLHZLIZUQE,Alkaloids,Tyrosine alkaloids,,Mucuna pruriens,569266.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Mucuna'],['Mucuna pruriens'],4,0,5.534912943840027 4227,4414,-1,,,,0.0,MS1_match,ZTKRNEHDDSFTES-RFHDDPBLSA-N,"InChI=1S/C12H15ClO6/c1-5-10-18-9(15)8-11(5,16)3-7(17-6(2)14)12(8,4-13)19-10/h7-10,15-16H,1,3-4H2,2H3/t7-,8-,9+,10-,11-,12+/m1/s1",C=C1[C@@H]2O[C@H](O)[C@H]3[C@@](CCl)(O2)[C@H](OC(C)=O)C[C@@]13O,C12H15ClO6,pos_1_1proton1dmso,290.05571588,ZTKRNEHDDSFTES,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4228,4414,-1,,,,0.0,MS1_match,ZTKRNEHDDSFTES-UHFFFAOYSA-N,"InChI=1S/C12H15ClO6/c1-5-10-18-9(15)8-11(5,16)3-7(17-6(2)14)12(8,4-13)19-10/h7-10,15-16H,1,3-4H2,2H3",C=C1C2OC(O)C3C1(O)CC(OC(C)=O)C3(CCl)O2,C12H15ClO6,pos_1_1proton1dmso,290.05571588,ZTKRNEHDDSFTES,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4229,4412,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.5561257,ISDB,VHFYCADQVMYJEI-OCCSQVGLSA-N,"InChI=1S/C14H22/c1-10(2)13-8-7-12-6-4-5-11(3)14(12)9-13/h12,14H,3-9H2,1-2H3/t12-,14+/m1/s1",C=C1CCC[C@@H]2CCC(=C(C)C)C[C@@H]12,C14H22,,190.172150704,VHFYCADQVMYJEI,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Trichogonia salviifolia,5739079.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Trichogonia'],['Trichogonia salviifolia'],4,3,7.724502801895142 4230,4411,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,STSJHYHSVQPPEC-BGKGJTHRSA-N,"InChI=1S/C10H16O4/c1-5-4-14-10(13)9-6(5)2-8(12)7(9)3-11/h5-9,11-12H,2-4H2,1H3/t5-,6+,7-,8-,9-/m0/s1",C[C@H]1COC(=O)[C@@H]2[C@@H](CO)[C@@H](O)C[C@@H]21,C10H16O4,pos_1_1proton,200.104858992,STSJHYHSVQPPEC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,3,7.5 4231,4411,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PEZCHMXCLXLNIE-UHFFFAOYSA-N,"InChI=1S/C10H16O4/c1-5-4-14-9(12)8-6(5)3-7(11)10(8,2)13/h5-8,11,13H,3-4H2,1-2H3",CC1COC(=O)C2C1CC(O)C2(C)O,C10H16O4,pos_1_1proton,200.104858992,PEZCHMXCLXLNIE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 4232,4411,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RPOWAISXPHIEJS-QKDRXXQKSA-N,"InChI=1S/C10H16O4/c1-5-6-3-8(11)10(2,13)7(6)4-14-9(5)12/h5-8,11,13H,3-4H2,1-2H3/t5-,6?,7?,8+,10+/m1/s1",C[C@H]1C(=O)OCC2C1C[C@H](O)[C@@]2(C)O,C10H16O4,pos_1_1proton,200.104858992,RPOWAISXPHIEJS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 4233,4411,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RPOWAISXPHIEJS-XAVNFNALSA-N,"InChI=1S/C10H16O4/c1-5-6-3-8(11)10(2,13)7(6)4-14-9(5)12/h5-8,11,13H,3-4H2,1-2H3/t5-,6-,7+,8+,10+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O,C10H16O4,pos_1_1proton,200.104858992,RPOWAISXPHIEJS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 4234,4410,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1potassium,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4235,4410,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1potassium,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4236,4409,-1,,,,0.36443684,ISDB,BTUZVFURXAOVBC-HQHBRHBDSA-N,"InChI=1S/C16H30O7/c1-4-16(3,21)7-5-6-10(2)9-22-15-14(20)13(19)12(18)11(8-17)23-15/h4,10-15,17-21H,1,5-9H2,2-3H3/t10-,11-,12-,13+,14-,15-,16-/m1/s1",C=C[C@@](C)(O)CCC[C@@H](C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H30O7,,334.1991533,BTUZVFURXAOVBC,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Conyza bonariensis,747355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Conyza'],['Conyza bonariensis'],4,0,5.4577473402023315 4237,4409,-1,,,,0.36443684,ISDB,BTUZVFURXAOVBC-HQHBRHBDSA-N,"InChI=1S/C16H30O7/c1-4-16(3,21)7-5-6-10(2)9-22-15-14(20)13(19)12(18)11(8-17)23-15/h4,10-15,17-21H,1,5-9H2,2-3H3/t10-,11-,12-,13+,14-,15-,16-/m1/s1",C=C[C@@](C)(O)CCC[C@@H](C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H30O7,,334.1991533,BTUZVFURXAOVBC,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Erigeron bonariensis,747355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Conyza'],['Conyza bonariensis'],4,0,5.4577473402023315 4238,4409,-1,,,,0.36443684,ISDB,BTUZVFURXAOVBC-UHFFFAOYSA-N,"InChI=1S/C16H30O7/c1-4-16(3,21)7-5-6-10(2)9-22-15-14(20)13(19)12(18)11(8-17)23-15/h4,10-15,17-21H,1,5-9H2,2-3H3",C=CC(C)(O)CCCC(C)COC1OC(CO)C(O)C(O)C1O,C16H30O7,,334.1991533,BTUZVFURXAOVBC,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Symphyotrichum subulatum,965961.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Symphyotrichum'],['Symphyotrichum subulatum'],4,0,5.4577473402023315 4239,4408,-1,,,,0.0,MS1_match,MPVZRKBKGSHLGP-VNOQCFOKSA-N,"InChI=1S/C12H16O3/c1-7-5-8(13)6-9-10(14)3-4-11(15)12(7,9)2/h3-4,6-8,11,13,15H,5H2,1-2H3/t7-,8-,11-,12+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C=C[C@@H](O)[C@]21C,C12H16O3,pos_1_1proton1acetonitrile,208.109944372,MPVZRKBKGSHLGP,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4240,4408,-1,,,,0.0,MS1_match,MPVZRKBKGSHLGP-VNOQCFOKSA-N,"InChI=1S/C12H16O3/c1-7-5-8(13)6-9-10(14)3-4-11(15)12(7,9)2/h3-4,6-8,11,13,15H,5H2,1-2H3/t7-,8-,11-,12+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C=C[C@@H](O)[C@]21C,C12H16O3,pos_1_1proton1acetonitrile,208.109944372,MPVZRKBKGSHLGP,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 4241,4408,-1,,,,0.0,MS1_match,DARGUPSDBIBHDD-SNVBAGLBSA-N,"InChI=1S/C12H16O3/c1-5-10(13-2)9-6-7-11(14-3)12(8-9)15-4/h5-8,10H,1H2,2-4H3/t10-/m1/s1",C=C[C@@H](OC)c1ccc(OC)c(OC)c1,C12H16O3,pos_1_1proton1acetonitrile,208.109944372,DARGUPSDBIBHDD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 4242,4408,-1,,,,0.0,MS1_match,ATPPQNYORHPCJE-UHFFFAOYSA-N,"InChI=1S/C29H42O4/c1-16-7-11-28-14-13-27(6)26(5)10-8-19-18(3)22(31)20(30)15-25(19,4)21(26)9-12-29(27,33-24(28)32)23(28)17(16)2/h9,12,16-17,19-23,30-31H,3,7-8,10-11,13-15H2,1-2,4-6H3",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2C=CC23OC(=O)C4(CCC(C)C(C)C42)CCC13C,C29H42O4,pos_2_2sodium,454.308309824,ATPPQNYORHPCJE,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4243,4408,-1,,,,0.0,MS1_match,ATPPQNYORHPCJE-UHFFFAOYSA-N,"InChI=1S/C29H42O4/c1-16-7-11-28-14-13-27(6)26(5)10-8-19-18(3)22(31)20(30)15-25(19,4)21(26)9-12-29(27,33-24(28)32)23(28)17(16)2/h9,12,16-17,19-23,30-31H,3,7-8,10-11,13-15H2,1-2,4-6H3",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2C=CC23OC(=O)C4(CCC(C)C(C)C42)CCC13C,C29H42O4,pos_2_2sodium,454.308309824,ATPPQNYORHPCJE,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 4244,4407,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.25514102,ISDB,RROGHRHLBLVQSG-ZIEWLMKPSA-N,"InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)53-34-32(28(45)23(44)19-51-34)54-33-31(48)30(47)29(46)24(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32-,33-,34-,37-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O13,,766.450342172,RROGHRHLBLVQSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,10.520564079284668 4245,4406,963,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.3092478,ISDB,QPXLXIOGKRSJSO-GSUPODNBSA-N,"InChI=1S/C22H34O14/c1-22(30)4-3-8-9(18(28)31-2)5-32-20(12(8)22)33-7-11-13(23)15(25)17(27)21(36-11)34-6-10-14(24)16(26)19(29)35-10/h5,8,10-17,19-21,23-27,29-30H,3-4,6-7H2,1-2H3/t8-,10-,11-,12-,13-,14+,15+,16-,17-,19-,20+,21-,22+/m1/s1",COC(=O)C1=CO[C@@H](OC[C@H]2O[C@@H](OC[C@H]3O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H]2[C@@H]1CC[C@]2(C)O,C22H34O14,,522.194855768,QPXLXIOGKRSJSO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Pedicularis plicata,5232492.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Pedicularideae'],['Pedicularis'],['Pedicularis plicata'],4,3,6.7369911670684814 4246,4404,-1,,,,0.27357486,ISDB,GMGRAGPXURLASU-UHFFFAOYSA-N,"InChI=1S/C35H52O6/c1-4-6-8-10-12-14-16-18-20-22-25-31(37)33(39)29-27-24-28(40-3)30(36)26(34(27)41-35(29)32(25)38)23-21-19-17-15-13-11-9-7-5-2/h24,36-37H,4-23H2,1-3H3",CCCCCCCCCCCC1=C(O)C(=O)c2c(oc3c(CCCCCCCCCCC)c(O)c(OC)cc23)C1=O,C35H52O6,,568.3763893839999,GMGRAGPXURLASU,Polyketides,Aromatic polyketides,,Aegiceras corniculatum,519879.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Aegiceras'],['Aegiceras corniculatum'],4,0,5.0942994356155396 4247,4402,-1,,,,0.0,MS1_match,TZTWOBUHCLWLNK-UHFFFAOYSA-N,"InChI=1S/C12H10O5/c13-5-9-1-3-11(16-9)7-15-8-12-4-2-10(6-14)17-12/h1-6H,7-8H2",O=Cc1ccc(COCc2ccc(C=O)o2)o1,C12H10O5,pos_1_1proton1ammonium,234.05282342,TZTWOBUHCLWLNK,Polyketides,Cyclic polyketides,Furans,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 4248,4401,-1,,,,0.0,MS1_match,XOXYHGOIRWABTC-UHFFFAOYSA-N,"InChI=1S/C14H10O5/c1-18-8-5-10(16)13-12(6-8)19-11-3-2-7(15)4-9(11)14(13)17/h2-6,15-16H,1H3",COc1cc(O)c2c(=O)c3cc(O)ccc3oc2c1,C14H10O5,pos_1_1sodium1acetonitrile,258.05282342000004,XOXYHGOIRWABTC,Shikimates and Phenylpropanoids,Xanthones,Plant xanthones,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4249,4401,-1,,,,0.0,MS1_match,XOXYHGOIRWABTC-UHFFFAOYSA-N,"InChI=1S/C14H10O5/c1-18-8-5-10(16)13-12(6-8)19-11-3-2-7(15)4-9(11)14(13)17/h2-6,15-16H,1H3",COc1cc(O)c2c(=O)c3cc(O)ccc3oc2c1,C14H10O5,pos_1_1sodium1acetonitrile,258.05282342000004,XOXYHGOIRWABTC,Shikimates and Phenylpropanoids,Xanthones,Plant xanthones,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4250,4397,-1,,,,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_sodium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4251,4397,-1,,,,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_sodium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 4252,4396,391,Alkaloids,Ornithine alkaloids,Polyamines,0.485146,ISDB,KTZNZCYTXQYEHT-GQCTYLIASA-N,"InChI=1S/C13H18N2O3/c14-7-1-2-8-15-13(18)6-4-10-3-5-11(16)12(17)9-10/h3-6,9,16-17H,1-2,7-8,14H2,(H,15,18)/b6-4+",NCCCCNC(=O)/C=C/c1ccc(O)c(O)c1,C13H18N2O3,,250.131742436,KTZNZCYTXQYEHT,Alkaloids,Ornithine alkaloids,Polyamines,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,7.440583944320679 4253,4396,391,Alkaloids,Ornithine alkaloids,Polyamines,0.485146,ISDB,KTZNZCYTXQYEHT-GQCTYLIASA-N,"InChI=1S/C13H18N2O3/c14-7-1-2-8-15-13(18)6-4-10-3-5-11(16)12(17)9-10/h3-6,9,16-17H,1-2,7-8,14H2,(H,15,18)/b6-4+",NCCCCNC(=O)/C=C/c1ccc(O)c(O)c1,C13H18N2O3,,250.131742436,KTZNZCYTXQYEHT,Alkaloids,Ornithine alkaloids,Polyamines,Iochroma cyaneum,974496.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Physaleae'],['Iochroma'],['Iochroma cyaneum'],4,3,7.440583944320679 4254,4396,391,Alkaloids,Ornithine alkaloids,Polyamines,0.485146,ISDB,KTZNZCYTXQYEHT-UHFFFAOYSA-N,"InChI=1S/C13H18N2O3/c14-7-1-2-8-15-13(18)6-4-10-3-5-11(16)12(17)9-10/h3-6,9,16-17H,1-2,7-8,14H2,(H,15,18)",NCCCCNC(=O)C=Cc1ccc(O)c(O)c1,C13H18N2O3,,250.131742436,KTZNZCYTXQYEHT,Alkaloids,Ornithine alkaloids,Polyamines,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,7.440583944320679 4255,4395,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.21877718,ISDB,VZLFSBWCXJMBOJ-UHFFFAOYSA-N,"InChI=1S/C27H32O4/c1-6-27(4,5)22-14-19(23(28)16-24(22)29)9-7-8-18-15-25(30)26-21(12-13-31-26)20(18)11-10-17(2)3/h6,10,12-16,28-30H,1,7-9,11H2,2-5H3",C=CC(C)(C)c1cc(CCCc2cc(O)c3occc3c2CC=C(C)C)c(O)cc1O,C27H32O4,,420.230059504,VZLFSBWCXJMBOJ,Shikimates and Phenylpropanoids,,,Broussonetia papyrifera,311274.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Broussonetia'],['Broussonetia papyrifera'],4,0,4.87510871887207 4256,4395,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.21877718,ISDB,VZLFSBWCXJMBOJ-UHFFFAOYSA-N,"InChI=1S/C27H32O4/c1-6-27(4,5)22-14-19(23(28)16-24(22)29)9-7-8-18-15-25(30)26-21(12-13-31-26)20(18)11-10-17(2)3/h6,10,12-16,28-30H,1,7-9,11H2,2-5H3",C=CC(C)(C)c1cc(CCCc2cc(O)c3occc3c2CC=C(C)C)c(O)cc1O,C27H32O4,,420.230059504,VZLFSBWCXJMBOJ,Shikimates and Phenylpropanoids,,,Broussonetia kazinoki,734176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Broussonetia'],['Broussonetia kazinoki'],4,0,4.87510871887207 4257,4392,1020,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,0.0,MS1_match,FPRGRROJPRIHJP-UHFFFAOYSA-N,"InChI=1S/C20H24O4/c1-9(2)11-7-13(21)19(5)17(15(11)23)20(6)14(22)8-12(10(3)4)16(24)18(19)20/h7-10,17-18H,1-6H3",CC(C)C1=CC(=O)C2(C)C(C1=O)C1(C)C(=O)C=C(C(C)C)C(=O)C21,C20H24O4,pos_1_1proton1ammonium,328.167459248,FPRGRROJPRIHJP,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 4258,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver pilosum,84032.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver pilosum'],4,3,6.894041538238525 4259,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver macrostomum,84036.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver macrostomum'],4,3,6.894041538238525 4260,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver alpinum,740031.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver alpinum'],4,3,6.894041538238525 4261,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver croceum,784404.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver nudicaule'],4,3,6.894041538238525 4262,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver pinnatifidum,605785.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver dubium'],4,3,6.894041538238525 4263,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver californicum,760916.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver californicum'],4,3,6.894041538238525 4264,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver setigerum,237515.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver somniferum'],4,3,6.894041538238525 4265,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver rupifragum,84025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver rupifragum'],4,3,6.894041538238525 4266,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver pavoninum,84038.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver pavoninum'],4,3,6.894041538238525 4267,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver decaisnei,6130804.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver decaisnei'],4,3,6.894041538238525 4268,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver oreophilum,6130838.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver oreophilum'],4,3,6.894041538238525 4269,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver alboroseum,66138.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver alboroseum'],4,3,6.894041538238525 4270,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver canescens,5727871.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver canescens'],4,3,6.894041538238525 4271,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver pseudocanescens,5727871.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver canescens'],4,3,6.894041538238525 4272,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver commutatum,605768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver commutatum'],4,3,6.894041538238525 4273,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver dubium,605785.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver dubium'],4,3,6.894041538238525 4274,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-WSTZPKSXSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18+,20-/m1/s1",COc1cc2c(cc1O)[C@@H]1O[C@@H](OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.1368873919999,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver fugax,6130809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver fugax'],4,3,6.894041538238525 4275,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-WSTZPKSXSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18+,20-/m1/s1",COc1cc2c(cc1O)[C@@H]1O[C@@H](OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.1368873919999,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver armeniacum,605764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver armeniacum'],4,3,6.894041538238525 4276,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver persicum,5727884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver persicum'],4,3,6.894041538238525 4277,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver lateritium,398982.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver lateritium'],4,3,6.894041538238525 4278,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver lecoqii,6130826.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver lecoqii'],4,3,6.894041538238525 4279,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver laevigatum,7591122.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver laevigatum'],4,3,6.894041538238525 4280,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-BJLQDIEVSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18-,20-/m0/s1",COc1cc2c(cc1O)[C@@H]1O[C@H](OC)c3c(ccc4c3OCO4)[C@@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver glaucum,84040.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver glaucum'],4,3,6.894041538238525 4281,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-PGYGNJIDSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18?,20?/m1/s1",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver somniferum,438118.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver somniferum'],4,3,6.894041538238525 4282,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-PGYGNJIDSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18?,20?/m1/s1",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver rhoeas,867221.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver rhoeas'],4,3,6.894041538238525 4283,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver pygmaeum,3944896.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver pygmaeum'],4,3,6.894041538238525 4284,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-PGYGNJIDSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18?,20?/m1/s1",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver argemone,605766.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver argemone'],4,3,6.894041538238525 4285,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-PGYGNJIDSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18?,20?/m1/s1",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver orientale,171970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver orientale'],4,3,6.894041538238525 4286,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-PGYGNJIDSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18?,20?/m1/s1",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver bracteatum,237538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver bracteatum'],4,3,6.894041538238525 4287,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-PGYGNJIDSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18?,20?/m1/s1",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Meconopsis cambrica,542241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Meconopsis'],['Meconopsis cambrica'],4,3,6.894041538238525 4288,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver atlanticum,605770.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver atlanticum'],4,3,6.894041538238525 4289,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver nudicaule,784404.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver nudicaule'],4,3,6.894041538238525 4290,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-UHFFFAOYSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)C1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver hybridum,84043.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver hybridum'],4,3,6.894041538238525 4291,4391,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.34851038,ISDB,YLUOVOKBMSLYGX-PGYGNJIDSA-N,"InChI=1S/C20H21NO6/c1-23-15-7-10-5-6-21-17-11-3-4-14-19(26-9-25-14)16(11)20(24-2)27-18(17)12(10)8-13(15)22/h3-4,7-8,17-18,20-22H,5-6,9H2,1-2H3/t17-,18?,20?/m1/s1",COc1cc2c(cc1O)C1OC(OC)c3c(ccc4c3OCO4)[C@H]1NCC2,C20H21NO6,,371.136887392,YLUOVOKBMSLYGX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Papaver albiflorum,5727872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver albiflorum'],4,3,6.894041538238525 4292,4390,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7034478,ISDB,BNJOQKFENDDGSC-UHFFFAOYSA-N,"InChI=1S/C18H34O4/c19-17(20)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(21)22/h1-16H2,(H,19,20)(H,21,22)",O=C(O)CCCCCCCCCCCCCCCCC(=O)O,C18H34O4,,314.245709568,BNJOQKFENDDGSC,Fatty acids,Fatty Acids and Conjugates,Dicarboxylic acids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,2,7.813791275024414 4293,4389,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.23780347,ISDB,,,,,,,BMENORHYYZFIIG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9512138962745667 4294,4388,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1potassium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4295,4388,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1potassium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4296,4388,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1potassium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4297,4387,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,GNWJYPQYWBLOGD-UHFFFAOYSA-N,"InChI=1S/C15H28O/c1-10(2)12-7-8-15(4)13(9-12)11(3)5-6-14(15)16/h10-14,16H,5-9H2,1-4H3",CC(C)C1CCC2(C)C(O)CCC(C)C2C1,C15H28O,pos_2MH,224.214015516,GNWJYPQYWBLOGD,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4298,4387,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,XJUPKJSSFJJSEQ-UHFFFAOYSA-N,"InChI=1S/C15H28O/c1-11-6-5-7-12-8-9-13(14(2,3)16)10-15(11,12)4/h11-13,16H,5-10H2,1-4H3",CC1CCCC2CCC(C(C)(C)O)CC12C,C15H28O,pos_2MH,224.214015516,XJUPKJSSFJJSEQ,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4299,4385,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4300,4385,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4301,4382,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.76384723,ISDB,CUHJQOVOXFVMSQ-UHFFFAOYSA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h7,10,13,16-17,19H,2-6,8-9,11-12,14-15H2,1H3,(H,20,21)",CCCCCCCCCC(O)CCCC=CC=CC(=O)O,C18H32O3,,296.235144884,CUHJQOVOXFVMSQ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Taraxacum platycarpum,793946.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Taraxacum'],['Taraxacum platycarpum'],4,3,8.555388927459717 4302,4381,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4303,4381,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4304,4381,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4305,4372,-1,,,,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_2MH,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4306,4372,-1,,,,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_2MH,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 4307,4372,-1,,,,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_2MH,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 4308,4372,-1,,,,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_2MH,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4309,4372,-1,,,,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_2MH,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4310,4372,-1,,,,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_2MH,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 4311,4370,-1,,,,0.33764714,ISDB,HGBZMCXKHKZYBF-BDVZBAKESA-N,"InChI=1S/C42H55NO7/c1-20(2)17-28-47-32-34(38(7,8)48-28)46-27-14-15-39(9)40(10)21(13-16-41(39,45)42(27)35(32)49-42)18-24-29-23-19-25-30(37(5,6)50-36(25,3)4)31(44)22(23)11-12-26(29)43-33(24)40/h11-12,17,21,25,27-28,30,32,34-35,43,45H,13-16,18-19H2,1-10H3/t21-,25+,27+,28-,30-,32+,34+,35-,39+,40+,41-,42-/m0/s1",CC(C)=C[C@H]1O[C@@H]2[C@@H](O[C@@H]3CC[C@@]4(C)[C@@](O)(CC[C@H]5Cc6c([nH]c7ccc8c(c67)C[C@@H]6[C@@H](C8=O)C(C)(C)OC6(C)C)[C@@]54C)[C@]34O[C@@H]24)C(C)(C)O1,C42H55NO7,,685.3978531,HGBZMCXKHKZYBF,Alkaloids,Tryptophan alkaloids,Indole-Diterpenoid alkaloids (Penitrems),Lolium perenne,135774.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Poeae'],['Lolium'],['Lolium perenne'],4,0,5.35058856010437 4312,4368,372,Fatty acids,Fatty Acids and Conjugates,Fatty alcohols,0.5730056,ISDB,MDJZLBDKRQWNKH-UHFFFAOYSA-N,"InChI=1S/C30H58O3/c1-3-4-5-6-7-8-9-10-11-14-17-20-23-26-29(31)27-24-21-18-15-12-13-16-19-22-25-28-30(32)33-2/h3-28H2,1-2H3",CCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCC(=O)OC,C30H58O3,,466.438595716,MDJZLBDKRQWNKH,Fatty acids,Fatty Acids and Conjugates,Oxo fatty acids,Tridax procumbens,709028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Millerieae'],['Tridax'],['Tridax procumbens'],4,2,7.292022466659546 4313,4367,517,Amino acids and Peptides,Amino acid glycosides,Pyridine alkaloids,0.43334582,ISDB,MDLTWTOQCHCLSZ-UHFFFAOYSA-N,"InChI=1S/C14H21NO8/c1-6-10(18)8(3-16)7(2-15-6)5-22-14-13(21)12(20)11(19)9(4-17)23-14/h2,9,11-14,16-21H,3-5H2,1H3",Cc1ncc(COC2OC(CO)C(O)C(O)C2O)c(CO)c1O,C14H21NO8,,331.126716632,MDLTWTOQCHCLSZ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Pisum sativum,359905.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Pisum'],['Pisum sativum'],4,3,7.233383297920227 4314,4366,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4315,4366,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4316,4366,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 4317,4366,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 4318,4364,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.32566229,ISDB,BFSRJRKZZSIEFP-MOHLSBLISA-N,"InChI=1S/C30H46O2/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-20-25(3,4)23(31)10-11-26(20,5)21(27)9-13-30(28,32-19-29)22(29)18-24/h9,13,20-22H,8,10-12,14-19H2,1-7H3/t20-,21-,22-,26+,27-,28+,29-,30-/m1/s1",CC1(C)CC[C@@]23CC[C@@]4(C)[C@]5(C)CC[C@@H]6C(C)(C)C(=O)CC[C@]6(C)[C@H]5C=C[C@@]4(OC2)[C@@H]3C1,C30H46O2,,438.349780712,BFSRJRKZZSIEFP,Terpenoids,Triterpenoids,Oleanane triterpenoids,Viburnum odoratissimum var. awabuki,90825.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum awabuki'],5,3,7.802649140357971 4319,4362,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.24950835,ISDB,CCRXMHCQWYVXTE-AWALXHGNSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24+,25+,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,43-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O18,,928.503165592,CCRXMHCQWYVXTE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,10.49803340435028 4320,4361,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.34972653,ISDB,DFBQUTBOVLBEHN-DYLKLMJLSA-N,"InChI=1S/C40H64O12/c1-35(2)14-15-40(34(47)48)21(16-35)20-8-9-25-37(5)12-11-27(36(3,4)24(37)10-13-38(25,6)39(20,7)17-26(40)42)52-33-31(46)29(44)23(19-50-33)51-32-30(45)28(43)22(41)18-49-32/h8,21-33,41-46H,9-19H2,1-7H3,(H,47,48)/t21-,22+,23+,24+,25+,26-,27+,28+,29+,30-,31-,32+,33+,37+,38-,39-,40-/m1/s1",CC1(C)CC[C@]2(C(=O)O)[C@H](O)C[C@]3(C)C(=CC[C@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]2C1,C40H64O12,,736.439777488,DFBQUTBOVLBEHN,Terpenoids,Triterpenoids,Oleanane triterpenoids,Deutzia hookeriana,5740066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Unknown'],['Deutzia'],['Deutzia hookeriana'],4,3,6.898906111717224 4321,4361,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.34972653,ISDB,DFBQUTBOVLBEHN-DYLKLMJLSA-N,"InChI=1S/C40H64O12/c1-35(2)14-15-40(34(47)48)21(16-35)20-8-9-25-37(5)12-11-27(36(3,4)24(37)10-13-38(25,6)39(20,7)17-26(40)42)52-33-31(46)29(44)23(19-50-33)51-32-30(45)28(43)22(41)18-49-32/h8,21-33,41-46H,9-19H2,1-7H3,(H,47,48)/t21-,22+,23+,24+,25+,26-,27+,28+,29+,30-,31-,32+,33+,37+,38-,39-,40-/m1/s1",CC1(C)CC[C@]2(C(=O)O)[C@H](O)C[C@]3(C)C(=CC[C@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]2C1,C40H64O12,,736.439777488,DFBQUTBOVLBEHN,Terpenoids,Triterpenoids,Oleanane triterpenoids,Deutzia corymbosa,282348.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Unknown'],['Deutzia'],['Deutzia corymbosa'],4,3,6.898906111717224 4322,4360,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.22147983,ISDB,,,,,,,LSDSPQRSBDYPQZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8859193325042725 4323,4358,-1,,,,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-N,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/t16-,17+,18+,19-,21?/m1/s1",[O-]c1cc(-c2[o+]c3cc(O)cc(O)c3cc2OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C21H20O11,pos_1_1proton1isopropanol,448.10056146,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 4324,4358,-1,,,,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-O,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17+,18+,19-,21?/m1/s1",OC[C@H]1OC(Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O,C21H21O11+,pos_1_1proton1isopropanol,449.10783791209,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caucasica,5746390.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caucasica'],7,0,7.0 4325,4358,-1,,,,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-N,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/t16-,17+,18+,19-,21?/m1/s1",[O-]c1cc(-c2[o+]c3cc(O)cc(O)c3cc2OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C21H20O11,pos_1_1proton1isopropanol,448.10056146,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 4326,4358,-1,,,,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-O,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17+,18+,19-,21?/m1/s1",OC[C@H]1OC(Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O,C21H21O11+,pos_1_1proton1isopropanol,449.10783791209,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caucasica,5746390.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caucasica'],7,0,7.0 4327,4356,-1,,,,0.0,MS1_match,WYROMXDQWJEWEB-ULITYQDJSA-N,"InChI=1S/C26H28O16/c27-6-14-17(32)20(35)22(37)25(40-14)38-9-4-12(31)16-13(5-9)39-23(8-1-2-10(29)11(30)3-8)24(19(16)34)42-26-21(36)18(33)15(7-28)41-26/h1-5,14-15,17-18,20-22,25-33,35-37H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C26H28O16,pos_2_2sodium,596.137734816,WYROMXDQWJEWEB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,0,6.0 4328,4356,-1,,,,0.0,MS1_match,WYROMXDQWJEWEB-ULITYQDJSA-N,"InChI=1S/C26H28O16/c27-6-14-17(32)20(35)22(37)25(40-14)38-9-4-12(31)16-13(5-9)39-23(8-1-2-10(29)11(30)3-8)24(19(16)34)42-26-21(36)18(33)15(7-28)41-26/h1-5,14-15,17-18,20-22,25-33,35-37H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C26H28O16,pos_2_2sodium,596.137734816,WYROMXDQWJEWEB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,0,6.0 4329,4356,-1,,,,0.0,MS1_match,CKTYBTRYMOEPOK-QFKZPZKGSA-N,"InChI=1S/C26H28O16/c27-10-2-1-8(3-11(10)28)24-21(35)19(33)16-12(29)4-9(5-14(16)41-24)40-26-23(37)20(34)18(32)15(42-26)7-39-25-22(36)17(31)13(30)6-38-25/h1-5,13,15,17-18,20,22-23,25-32,34-37H,6-7H2/t13-,15+,17-,18+,20-,22+,23+,25-,26+/m0/s1",O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4OC[C@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C26H28O16,pos_2_2sodium,596.137734816,CKTYBTRYMOEPOK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,0,6.0 4330,4356,-1,,,,0.0,MS1_match,CKTYBTRYMOEPOK-QFKZPZKGSA-N,"InChI=1S/C26H28O16/c27-10-2-1-8(3-11(10)28)24-21(35)19(33)16-12(29)4-9(5-14(16)41-24)40-26-23(37)20(34)18(32)15(42-26)7-39-25-22(36)17(31)13(30)6-38-25/h1-5,13,15,17-18,20,22-23,25-32,34-37H,6-7H2/t13-,15+,17-,18+,20-,22+,23+,25-,26+/m0/s1",O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4OC[C@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C26H28O16,pos_2_2sodium,596.137734816,CKTYBTRYMOEPOK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 4331,4356,-1,,,,0.0,MS1_match,CKTYBTRYMOEPOK-QFKZPZKGSA-N,"InChI=1S/C26H28O16/c27-10-2-1-8(3-11(10)28)24-21(35)19(33)16-12(29)4-9(5-14(16)41-24)40-26-23(37)20(34)18(32)15(42-26)7-39-25-22(36)17(31)13(30)6-38-25/h1-5,13,15,17-18,20,22-23,25-32,34-37H,6-7H2/t13-,15+,17-,18+,20-,22+,23+,25-,26+/m0/s1",O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4OC[C@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C26H28O16,pos_2_2sodium,596.137734816,CKTYBTRYMOEPOK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,0,6.0 4332,4352,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.22903076,ISDB,,,,,,,UEMGEMFUMMACSA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9161230325698853 4333,4349,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.6008531,ISDB,BDUAKLHVCJVMNM-UHFFFAOYSA-N,"InChI=1S/C36H38N4O5/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)44-7)33(39-25)31-32(36(43)45-8)35(42)30-19(6)26(40-34(30)31)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,32,37-38H,1,10-12H2,2-8H3",C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[nH]2)c(C)c6CC)C(C)=C5C(=O)C4C(=O)OC)C(CCC(=O)OC)C3C,C36H38N4O5,,606.2842203160001,BDUAKLHVCJVMNM,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Clerodendrum cyrtophyllum,886107.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum cyrtophyllum'],4,3,7.903412342071533 4334,4349,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.6008531,ISDB,BDUAKLHVCJVMNM-UHFFFAOYSA-N,"InChI=1S/C36H38N4O5/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)44-7)33(39-25)31-32(36(43)45-8)35(42)30-19(6)26(40-34(30)31)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,32,37-38H,1,10-12H2,2-8H3",C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[nH]2)c(C)c6CC)C(C)=C5C(=O)C4C(=O)OC)C(CCC(=O)OC)C3C,C36H38N4O5,,606.2842203160001,BDUAKLHVCJVMNM,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Clerodendrum calamitosum,6086132.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum calamitosum'],4,3,7.903412342071533 4335,4346,-1,,,,0.7919796,ISDB,CNNSEHUKQJCGTE-UPPWDXJYSA-N,"InChI=1S/C42H78NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h14,16,20-21,25,27,40H,6-13,15,17-19,22-24,26,28-39H2,1-5H3/b16-14-,21-20-,27-25-/t40-/m1/s1",CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C42H78NO8P,,755.546505086,CNNSEHUKQJCGTE,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,0,4.16791844367981 4336,4345,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.28690174,ISDB,ASSIBWYNZRJTFC-UHFFFAOYSA-N,"InChI=1S/C53H86O23/c1-48(2)14-15-53(47(68)76-45-41(67)37(63)35(61)27(73-45)21-70-46-42(38(64)34(60)26(19-55)72-46)75-44-40(66)36(62)33(59)25(18-54)71-44)23(16-48)22-8-9-29-50(5)12-11-31(74-43-39(65)32(58)24(56)20-69-43)49(3,4)28(50)10-13-51(29,6)52(22,7)17-30(53)57/h8,23-46,54-67H,9-21H2,1-7H3",CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1,C53H86O23,,1090.555989012,ASSIBWYNZRJTFC,Terpenoids,Triterpenoids,Oleanane triterpenoids,Agrostemma gracilis,5143766.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Sileneae'],['Agrostemma'],['Agrostemma brachyloba'],4,3,6.6476069688797 4337,4345,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.28690174,ISDB,ASSIBWYNZRJTFC-XTQPHZDFSA-N,"InChI=1S/C53H86O23/c1-48(2)14-15-53(47(68)76-45-41(67)37(63)35(61)27(73-45)21-70-46-42(38(64)34(60)26(19-55)72-46)75-44-40(66)36(62)33(59)25(18-54)71-44)23(16-48)22-8-9-29-50(5)12-11-31(74-43-39(65)32(58)24(56)20-69-43)49(3,4)28(50)10-13-51(29,6)52(22,7)17-30(53)57/h8,23-46,54-67H,9-21H2,1-7H3/t23-,24+,25+,26+,27+,28-,29+,30+,31-,32-,33+,34+,35+,36-,37-,38-,39+,40+,41+,42+,43-,44-,45-,46+,50-,51+,52+,53+/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C53H86O23,,1090.555989012,ASSIBWYNZRJTFC,Terpenoids,Triterpenoids,Oleanane triterpenoids,Agrostemma brachyloba,5143766.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Sileneae'],['Agrostemma'],['Agrostemma brachyloba'],4,3,6.6476069688797 4338,4343,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.6432308,ISDB,UQTDTFGCPOVWBK-CSXWMVMESA-N,"InChI=1S/C22H30O3/c1-18(2)15-12-16(23)20(4)14(19(15,3)10-7-17(24)25-18)6-11-21-8-5-9-22(20,21)13-21/h7,10,14-15H,5-6,8-9,11-13H2,1-4H3/t14-,15+,19-,20+,21-,22-/m1/s1",CC1(C)OC(=O)C=C[C@]2(C)[C@H]3CC[C@@]45CCC[C@@]4(C5)[C@]3(C)C(=O)C[C@@H]12,C22H30O3,,342.21949482,UQTDTFGCPOVWBK,Terpenoids,Triterpenoids,Cycloapotirucallane triterpenoids,Simarouba amara,452697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Simaroubaceae'],['Unknown'],['Simarouba'],['Simarouba amara'],4,1,7.072923183441162 4339,4342,-1,,,,0.29939973,ISDB,FTPYFKFDSUGCPB-SIKLNZKXSA-N,"InChI=1S/C22H26O3/c1-21(2)7-4-8-22(3)17-11-15-16(9-13(17)5-6-19(21)22)20(25)14(12-23)10-18(15)24/h9-11,19,23H,4-8,12H2,1-3H3/t19-,22+/m0/s1",CC1(C)CCC[C@]2(C)c3cc4c(cc3CC[C@@H]12)C(=O)C(CO)=CC4=O,C22H26O3,,338.188194692,FTPYFKFDSUGCPB,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Phyllosticta spinarum,56261.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Botryosphaeriales'],['Phyllostictaceae'],['Unknown'],['Phyllosticta'],['Phyllosticta spinarum'],1,0,2.197598934173584 4340,4340,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.6238485,ISDB,GLZPCOQZEFWAFX-JXMROGBWSA-N,"InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+",CC(C)=CCC/C(C)=C/CO,C10H18O,,154.135765196,GLZPCOQZEFWAFX,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,10.495393991470337 4341,4339,63,Terpenoids,Small peptides,Secoiridoid monoterpenoids,0.0,MS1_match,JNPXCTROEJQHKD-KAZAEUKGSA-N,"InChI=1S/C21H30O13/c1-2-9-10-3-4-29-17(27)11(10)5-30-18(9)34-19-15(25)14(24)13(23)12(33-19)6-31-20-16(26)21(28,7-22)8-32-20/h2,5,9-10,12-16,18-20,22-26,28H,1,3-4,6-8H2/t9-,10-,12+,13+,14-,15+,16-,18-,19-,20+,21+/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C21H30O13,pos_2_1proton1potassium,490.16864102,JNPXCTROEJQHKD,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,3,8.5 4342,4336,-1,,,,0.0,MS1_match,SWRDFZJYXUGADQ-YTTQTOCMSA-N,"InChI=1S/C27H38O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,10-14,16-22,25-27,29-32,35H,1,5,7-9H2,2-3H3/t11-,12-,13-,14+,16-,17-,18+,19+,20+,21-,22+,25+,26-,27-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@H]3[C@@H]([C@H]2C)[C@H](O)OC[C@@H]3C(=O)OC)[C@H]1CC=O,C27H38O14,pos_2_2sodium,586.226155896,SWRDFZJYXUGADQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Abelia chinensis,589178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Abelia'],['Abelia chinensis'],6,0,6.0 4343,4336,-1,,,,0.0,MS1_match,MXXRZVWQIBOVFZ-CQWPOWKPSA-N,"InChI=1S/C27H38O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,9-14,17-22,25-32,35H,1,5-8H2,2-3H3/t11-,12+,13-,14+,17-,18+,19+,20+,21-,22+,25+,26-,27-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@@H]3[C@H]2C)[C@H]1CCO,C27H38O14,pos_2_2sodium,586.2261558959999,MXXRZVWQIBOVFZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 4344,4335,-1,,,,0.4290711,ISDB,NGQYMQUJKWAWDD-RRHRKEPWSA-N,"InChI=1S/C14H19NO4/c1-3-4-5-6-7-8-10(17)11-13(18)12(9(2)16)15-14(11)19/h5-9,12,16-17H,3-4H2,1-2H3,(H,15,19)/b6-5+,8-7+,11-10-",CCC/C=C/C=C/C(O)=C1/C(=O)NC(C(C)O)C1=O,C14H19NO4,,265.131408088,NGQYMQUJKWAWDD,Polyketides,Linear polyketides,3-oligoenoyltetramic acids,Aspergillus terreus,104248.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus terreus'],1,0,2.716284394264221 4345,4333,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4346,4333,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4347,4333,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4348,4333,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4349,4333,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4350,4333,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4351,4332,-1,,,,0.4054878,ISDB,MLBALSMBMWNBCE-KVZAPANVSA-N,"InChI=1S/C17H23NO7/c1-9-15(20)24-10(2)17(9,22)16(21)23-8-12-4-6-18-7-5-13(14(12)18)25-11(3)19/h4,9-10,13-14,22H,5-8H2,1-3H3/t9-,10-,13+,14+,17+/m0/s1",CC(=O)O[C@@H]1CCN2CC=C(COC(=O)[C@]3(O)[C@H](C)OC(=O)[C@@H]3C)[C@H]12,C17H23NO7,,353.147452076,MLBALSMBMWNBCE,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Hackelia velutina,3869452.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Boraginaceae'],['Rochelieae'],['Hackelia'],['Hackelia velutina'],4,0,5.621951222419739 4352,4331,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.24399692,ISDB,YCIZAGMNZSNASP-IRXDYDNUSA-N,"InChI=1S/C17H22N2O6/c1-10(2)16(24-4)14(22)18-17(25-5,15(19-16)23-3)13(21)11-6-8-12(20)9-7-11/h6-10,20H,1-5H3,(H,18,22)/t16-,17-/m0/s1",COC1=N[C@](OC)(C(C)C)C(=O)N[C@]1(OC)C(=O)c1ccc(O)cc1,C17H22N2O6,,350.147786424,YCIZAGMNZSNASP,Alkaloids,Peptide alkaloids,,Phoma herbarum,437937.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Didymellaceae'],['Unknown'],['Phoma'],['Phoma herbarum'],1,1,2.475987672805786 4353,4331,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.24399692,ISDB,YCIZAGMNZSNASP-UHFFFAOYSA-N,"InChI=1S/C17H22N2O6/c1-10(2)16(24-4)14(22)18-17(25-5,15(19-16)23-3)13(21)11-6-8-12(20)9-7-11/h6-10,20H,1-5H3,(H,18,22)",COC1=NC(OC)(C(C)C)C(=O)NC1(OC)C(=O)c1ccc(O)cc1,C17H22N2O6,,350.147786424,YCIZAGMNZSNASP,Alkaloids,Peptide alkaloids,,Boeremia exigua,30694.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Didymellaceae'],['Unknown'],['Boeremia'],['Boeremia exigua'],1,1,2.475987672805786 4354,4329,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.30985123,ISDB,YEQBGJNMHDZXRG-NMTUBSNHSA-N,"InChI=1S/C27H40O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h5,7-8,17-18,20-24H,6,9-16H2,1-4H3/t17-,18+,20-,21-,22-,23+,24+,25-,26+,27-/m0/s1",C[C@H]1CC[C@]2(OC1)O[C@@H]1C[C@H]3[C@H]4CC=C5C=CCC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]1[C@H]2C,C27H40O2,,396.30283051999993,YEQBGJNMHDZXRG,Terpenoids,Steroids,Spirostane steroids,Trigonella foenum-graecum,1007994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trigonella'],['Trigonella foenum-graecum'],4,1,5.739404916763306 4355,4323,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.23187423,ISDB,YEQBGJNMHDZXRG-NMTUBSNHSA-N,"InChI=1S/C27H40O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h5,7-8,17-18,20-24H,6,9-16H2,1-4H3/t17-,18+,20-,21-,22-,23+,24+,25-,26+,27-/m0/s1",C[C@H]1CC[C@]2(OC1)O[C@@H]1C[C@H]3[C@H]4CC=C5C=CCC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]1[C@H]2C,C27H40O2,,396.30283051999993,YEQBGJNMHDZXRG,Terpenoids,Steroids,Spirostane steroids,Trigonella foenum-graecum,1007994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trigonella'],['Trigonella foenum-graecum'],4,1,5.427496910095215 4356,4322,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.6678599,ISDB,RLWJIETUBNSFMD-VMPITWQZSA-N,"InChI=1S/C20H21NO5/c1-23-16-6-3-14(11-18(16)24-2)5-8-20(22)21-10-9-15-4-7-17-19(12-15)26-13-25-17/h3-8,11-12H,9-10,13H2,1-2H3,(H,21,22)/b8-5+",COc1ccc(/C=C/C(=O)NCCc2ccc3c(c2)OCO3)cc1OC,C20H21NO5,,355.141972772,RLWJIETUBNSFMD,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Zanthoxylum rubescens,5762616.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum rubescens'],4,3,8.17143964767456 4357,4321,-1,,,,0.256513,ISDB,GLNRAZLQBMAROT-LURJTMIESA-N,"InChI=1S/C10H11NO3/c1-6-9(5-12)7-2-3-14-10(13)8(7)4-11-6/h4-6,11H,2-3H2,1H3/t6-/m0/s1",C[C@@H]1NC=C2C(=O)OCCC2=C1C=O,C10H11NO3,,193.073893212,GLNRAZLQBMAROT,,,,Swertia marginata,909863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Swertia'],['Swertia marginata'],4,0,5.026051998138428 4358,4320,-1,,,,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton1ammonium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4359,4320,-1,,,,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton1ammonium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4360,4319,767,Alkaloids,Lignans,3-Spirotetramic acids,0.3207787,ISDB,FFIHXENRVXVAGQ-UVLSWTAMSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11+,13-,14-/m1/s1",CC/C=C1/C=CC(=O)[C@@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Curvularia pallescens,868065.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Cochliobolus'],['Pseudocochliobolus pallescens'],1,3,3.783114790916443 4361,4319,767,Alkaloids,Lignans,3-Spirotetramic acids,0.3207787,ISDB,FFIHXENRVXVAGQ-UVLSWTAMSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11+,13-,14-/m1/s1",CC/C=C1/C=CC(=O)[C@@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Staphylotrichum coccosporum,630050.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Sordariales'],['Chaetomiaceae'],['Unknown'],['Staphylotrichum'],['Staphylotrichum coccosporum'],1,3,3.783114790916443 4362,4319,767,Alkaloids,Lignans,3-Spirotetramic acids,0.3207787,ISDB,FFIHXENRVXVAGQ-KZZKGCKGSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1",CC/C=C1/C=CC(=O)[C@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Drechslera,432344.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Drechslera'],['Unknown'],1,3,3.783114790916443 4363,4319,767,Alkaloids,Lignans,3-Spirotetramic acids,0.3207787,ISDB,FFIHXENRVXVAGQ-KZZKGCKGSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1",CC/C=C1/C=CC(=O)[C@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Pyrenophora tritici-repentis,85506.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Pyrenophora'],['Pyrenophora tritici-repentis'],1,3,3.783114790916443 4364,4318,-1,,,,0.31903797,ISDB,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,9.276151895523071 4365,4317,75,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,0.7305126,ISDB,WLFMEQAKLOQAMK-UHFFFAOYSA-N,"InChI=1S/C18H19NO5/c1-22-14-8-18-4-2-15(20)19(18)5-3-10-6-12-13(24-9-23-12)7-11(10)16(18)17(14)21/h6-8,16-17,21H,2-5,9H2,1H3",COC1=CC23CCC(=O)N2CCc2cc4c(cc2C3C1O)OCO4,C18H19NO5,,329.126322708,WLFMEQAKLOQAMK,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Cephalotaxus harringtonia,10224.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Unknown'],['Cupressales'],['Taxaceae'],['Unknown'],['Cephalotaxus'],['Cephalotaxus harringtonia'],3,3,7.422050476074219 4366,4315,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.39524856,ISDB,ZNBLGYROZNSLLT-BQTIJYENSA-N,"InChI=1S/C35H54O7/c1-18(2)27-21-14-19(3)28-31(6)12-13-34-17-33(34)11-10-24(40-29-26(38)25(37)20(36)15-39-29)30(4,5)22(33)8-9-23(34)32(31,7)16-35(28,41-21)42-27/h19-29,36-38H,1,8-17H2,2-7H3/t19-,20-,21-,22+,23+,24+,25+,26-,27-,28-,29+,31-,32+,33-,34+,35-/m1/s1",C=C(C)[C@H]1O[C@]23C[C@@]4(C)[C@@H]5CC[C@H]6C(C)(C)[C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)CC[C@@]67C[C@@]57CC[C@]4(C)[C@H]2[C@H](C)C[C@H]1O3,C35H54O7,,586.3869540679999,ZNBLGYROZNSLLT,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea asiatica,462241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea asiatica'],6,2,8.580994248390198 4367,4314,767,Alkaloids,Lignans,3-Spirotetramic acids,0.3409352,ISDB,RMVYYJRTYQWDRK-UHFFFAOYSA-N,"InChI=1S/C11H15NO4/c1-16-8-10-5-4-9(7-13)12(10)6-2-3-11(14)15/h4-5,7H,2-3,6,8H2,1H3,(H,14,15)",COCc1ccc(C=O)n1CCCC(=O)O,C11H15NO4,,225.10010796,RMVYYJRTYQWDRK,Alkaloids,Proline alkaloids,Pyrrole alkaloids,Houttuynia cordata,972211.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Saururaceae'],['Unknown'],['Houttuynia'],['Houttuynia cordata'],4,1,5.863740801811218 4368,4314,767,Alkaloids,Lignans,3-Spirotetramic acids,0.3409352,ISDB,RMVYYJRTYQWDRK-UHFFFAOYSA-N,"InChI=1S/C11H15NO4/c1-16-8-10-5-4-9(7-13)12(10)6-2-3-11(14)15/h4-5,7H,2-3,6,8H2,1H3,(H,14,15)",COCc1ccc(C=O)n1CCCC(=O)O,C11H15NO4,,225.10010796,RMVYYJRTYQWDRK,Alkaloids,Proline alkaloids,Pyrrole alkaloids,Lycium chinense,58730.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Lycieae'],['Lycium'],['Lycium chinense'],4,1,5.863740801811218 4369,4314,767,Alkaloids,Lignans,3-Spirotetramic acids,0.3409352,ISDB,RMVYYJRTYQWDRK-UHFFFAOYSA-N,"InChI=1S/C11H15NO4/c1-16-8-10-5-4-9(7-13)12(10)6-2-3-11(14)15/h4-5,7H,2-3,6,8H2,1H3,(H,14,15)",COCc1ccc(C=O)n1CCCC(=O)O,C11H15NO4,,225.10010796,RMVYYJRTYQWDRK,Alkaloids,Proline alkaloids,Pyrrole alkaloids,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,1,5.863740801811218 4370,4312,-1,,,,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_sodium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4371,4312,-1,,,,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_sodium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4372,4312,-1,,,,0.0,MS1_match,NFIQKUQYFSTGFU-VWZQPUASSA-N,"InChI=1S/C47H76O17/c1-42(2)14-16-47(41(58)64-40-37(57)34(54)32(52)26(62-40)21-60-38-36(56)33(53)31(51)25(19-48)61-38)17-15-45(6)22(23(47)18-42)8-9-28-44(5)12-11-29(43(3,4)27(44)10-13-46(28,45)7)63-39-35(55)30(50)24(49)20-59-39/h8,23-40,48-57H,9-21H2,1-7H3/t23-,24-,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38+,39-,40-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O17,pos_1_sodium,912.5082509720002,NFIQKUQYFSTGFU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4373,4311,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 4374,4311,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,3,9.5 4375,4311,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 4376,4311,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,PGOYMURMZNDHNS-MYPRUECHSA-N,"InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O4,pos_1_1proton,472.355260016,PGOYMURMZNDHNS,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,3,9.5 4377,4309,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.32542196,ISDB,JTCZJEHFXLPGNO-HUXDRDGTSA-N,"InChI=1S/C16H28O8/c1-8(4-17)10-3-2-9(5-18)11(10)7-23-16-15(22)14(21)13(20)12(6-19)24-16/h9-22H,1-7H2/t9-,10-,11-,12-,13-,14+,15-,16-/m1/s1",C=C(CO)[C@H]1CC[C@H](CO)[C@H]1CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O8,,348.178417856,JTCZJEHFXLPGNO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Viburnum lantana,572547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum lantana'],5,3,7.801687836647034 4378,4308,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_2MNa,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,2,9.0 4379,4308,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_2MNa,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,2,9.0 4380,4307,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.21165591,ISDB,OECUDTNQFAWZDD-IKDXMHNJSA-N,"InChI=1S/C23H30O6/c1-12(11-21(5)20-22(6,29-20)15(4)27-21)9-13(2)18-23(7,28-18)19-14(3)16(25-8)10-17(24)26-19/h9-11,15,18,20H,1-8H3/b12-11+,13-9+/t15-,18-,20+,21+,22-,23+/m1/s1",COc1cc(=O)oc([C@@]2(C)O[C@@H]2/C(C)=C/C(C)=C/[C@]2(C)O[C@H](C)[C@@]3(C)O[C@H]32)c1C,C23H30O6,,402.2042386799999,OECUDTNQFAWZDD,Polyketides,Cyclic polyketides,,Penicillium aurantiogriseum,220634.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium aurantiogriseum'],1,0,1.8466236591339111 4381,4305,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.24568883,ISDB,CPWFSCYLMXLCDK-SFQUDFHCSA-N,"InChI=1S/C23H26O4/c1-16(2)8-7-9-17(3)12-13-27-19-14-20(24)22(21(25)15-19)23(26)18-10-5-4-6-11-18/h4-6,8,10-12,14-15,24-25H,7,9,13H2,1-3H3/b17-12+",CC(C)=CCC/C(C)=C/COc1cc(O)c(C(=O)c2ccccc2)c(O)c1,C23H26O4,,366.183109312,CPWFSCYLMXLCDK,Polyketides,Phloroglucinols,Acyl phloroglucinols,Hypericum sampsonii,354150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum sampsonii'],4,3,6.4827553033828735 4382,4305,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.24568883,ISDB,CPWFSCYLMXLCDK-UHFFFAOYSA-N,"InChI=1S/C23H26O4/c1-16(2)8-7-9-17(3)12-13-27-19-14-20(24)22(21(25)15-19)23(26)18-10-5-4-6-11-18/h4-6,8,10-12,14-15,24-25H,7,9,13H2,1-3H3",CC(C)=CCCC(C)=CCOc1cc(O)c(C(=O)c2ccccc2)c(O)c1,C23H26O4,,366.183109312,CPWFSCYLMXLCDK,Polyketides,Phloroglucinols,Acyl phloroglucinols,Cratoxylum sumatranum,6101310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Cratoxyleae'],['Cratoxylum'],['Cratoxylum sumatranum'],4,3,6.4827553033828735 4383,4305,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.24568883,ISDB,CPWFSCYLMXLCDK-SFQUDFHCSA-N,"InChI=1S/C23H26O4/c1-16(2)8-7-9-17(3)12-13-27-19-14-20(24)22(21(25)15-19)23(26)18-10-5-4-6-11-18/h4-6,8,10-12,14-15,24-25H,7,9,13H2,1-3H3/b17-12+",CC(C)=CCC/C(C)=C/COc1cc(O)c(C(=O)c2ccccc2)c(O)c1,C23H26O4,,366.183109312,CPWFSCYLMXLCDK,Polyketides,Phloroglucinols,Acyl phloroglucinols,Helichrysum litorale,641764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Helichrysum'],['Helichrysum litorale'],4,3,6.4827553033828735 4384,4305,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.24568883,ISDB,CPWFSCYLMXLCDK-SFQUDFHCSA-N,"InChI=1S/C23H26O4/c1-16(2)8-7-9-17(3)12-13-27-19-14-20(24)22(21(25)15-19)23(26)18-10-5-4-6-11-18/h4-6,8,10-12,14-15,24-25H,7,9,13H2,1-3H3/b17-12+",CC(C)=CCC/C(C)=C/COc1cc(O)c(C(=O)c2ccccc2)c(O)c1,C23H26O4,,366.183109312,CPWFSCYLMXLCDK,Polyketides,Phloroglucinols,Acyl phloroglucinols,Tovomita longifolia,176665.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Clusieae'],['Tovomita'],['Tovomita longifolia'],4,3,6.4827553033828735 4385,4303,471,Shikimates and Phenylpropanoids,Monoterpenoids,Simple phenolic acids,0.0,MS1_match,HRGUSFBJBOKSML-UHFFFAOYSA-N,"InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)17(14)21)12-7-11(20)16-10(19)5-9(18)6-13(16)24-12/h3-7,18-19,21H,1-2H3",COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc(OC)c1O,C17H14O7,pos_1_1proton1ammonium,330.073952788,HRGUSFBJBOKSML,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,1,6.5 4386,4300,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_sodium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 4387,4298,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.25754794,ISDB,JVHYYZMBYJJGJM-ZMDGZUOKSA-N,"InChI=1S/C40H54O4/c1-29(17-13-19-31(3)21-22-35(42)38(9)26-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)27-34(44-40)28-39(40,10)43/h11-24,34,43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,38-,39+,40+/m0/s1",CC(/C=C/C=C(C)/C=C/C(=O)[C@]1(C)CC(=O)CC1(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@@H](CC1(C)C)C[C@@]2(C)O,C40H54O4,,598.402210208,JVHYYZMBYJJGJM,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-κ)",Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,6.030191779136658 4388,4296,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.34728327,ISDB,IEDHINQMIRRVDA-DBXUSRIBSA-N,"InChI=1S/C26H35NO11/c1-3-15-16(9-10-27-18(23(32)33)11-14-7-5-4-6-8-14)17(24(34)35-2)13-36-25(15)38-26-22(31)21(30)20(29)19(12-28)37-26/h3-8,13,15-16,18-22,25-31H,1,9-12H2,2H3,(H,32,33)/t15-,16+,18+,19-,20-,21+,22-,25+,26+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CCN[C@@H](Cc1ccccc1)C(=O)O,C26H35NO11,,537.2210109399998,IEDHINQMIRRVDA,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,9.389133095741272 4389,4295,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MNa,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 4390,4295,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MNa,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4391,4295,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_2MNa,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 4392,4295,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MNa,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 4393,4295,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MNa,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4394,4295,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_2MNa,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 4395,4294,-1,,,,0.37846953,ISDB,QLVTZLGYKYKHCT-WJWAULOUSA-N,"InChI=1S/C22H24O3/c1-13-14(2)22(16-4-6-18-10-24-12-20(18)8-16)25-21(13)15-3-5-17-9-23-11-19(17)7-15/h3-8,13-14,21-22H,9-12H2,1-2H3/t13-,14-,21-,22-/m0/s1",C[C@H]1[C@H](C)[C@@H](c2ccc3c(c2)COC3)O[C@@H]1c1ccc2c(c1)COC2,C22H24O3,,336.172544628,QLVTZLGYKYKHCT,Polyketides,,,Magnolia denudata,881612.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Magnoliaceae'],['Unknown'],['Magnolia'],['Magnolia denudata'],4,0,5.513878107070923 4396,4293,312,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.24749015,ISDB,AHJYJENDMNBMKK-UHFFFAOYSA-N,"InChI=1S/C15H19NO5/c1-10(17)16-13(14(19)7-8-15(20)21-2)9-11-3-5-12(18)6-4-11/h3-6,13,18H,7-9H2,1-2H3,(H,16,17)",COC(=O)CCC(=O)C(Cc1ccc(O)cc1)NC(C)=O,C15H19NO5,,293.126322708,AHJYJENDMNBMKK,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Nigrospora,758220.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Trichosphaeriales'],['Trichosphaeriaceae'],['Unknown'],['Nigrospora'],['Unknown'],1,0,1.9899606108665466 4397,4289,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.4455656,ISDB,MYQAIYGVAHDZRD-JUIQTESCSA-N,"InChI=1S/C29H44O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-11,13,19-21,23,25,27,30H,7,12,14-18H2,1-6H3/b9-8+/t20-,21-,23+,25-,27+,28+,29-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CC=C2C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(C)C,C29H44O,,408.339216028,MYQAIYGVAHDZRD,Terpenoids,Steroids,Ergostane steroids,Actinidia chinensis var. deliciosa,279986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Actinidiaceae'],['Unknown'],['Actinidia'],['Actinidia deliciosa'],4,1,6.282262444496155 4398,4288,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.2889214,ISDB,,,,,,,PZYVCAAILFDNEG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.155685544013977 4399,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,SXGDMINSYARVTP-ZTUHZDJASA-N,"InChI=1S/C17H28O3/c1-10-8-14(19-11(2)18)15-13(10)9-12-6-7-17(15,5)20-16(12,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12-,13-,14-,15+,17+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@H]2C[C@H]3CC[C@](C)(OC3(C)C)[C@@H]21,C17H28O3,pos_1_minus1proton2sodium,280.203844756,SXGDMINSYARVTP,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4400,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,SXGDMINSYARVTP-LPYKJYNFSA-N,"InChI=1S/C17H28O3/c1-10-8-14(19-11(2)18)15-13(10)9-12-6-7-17(15,5)20-16(12,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12+,13-,14-,15+,17-/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@H]2C[C@@H]3CC[C@@](C)(OC3(C)C)[C@@H]21,C17H28O3,pos_1_minus1proton2sodium,280.203844756,SXGDMINSYARVTP,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 4401,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,CGBOQYJQRLRGIE-QFCZPAJMSA-N,"InChI=1S/C17H28O3/c1-10-6-7-13-12(10)8-14-15(19-11(2)18)9-17(13,5)20-16(14,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12-,13-,14+,15+,17+/m1/s1",CC(=O)O[C@H]1C[C@]2(C)OC(C)(C)[C@H]1C[C@@H]1[C@H](C)CC[C@H]12,C17H28O3,pos_1_minus1proton2sodium,280.203844756,CGBOQYJQRLRGIE,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4402,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,CGBOQYJQRLRGIE-QFCZPAJMSA-N,"InChI=1S/C17H28O3/c1-10-6-7-13-12(10)8-14-15(19-11(2)18)9-17(13,5)20-16(14,3)4/h10,12-15H,6-9H2,1-5H3/t10-,12-,13-,14+,15+,17+/m1/s1",CC(=O)O[C@H]1C[C@]2(C)OC(C)(C)[C@H]1C[C@@H]1[C@H](C)CC[C@H]12,C17H28O3,pos_1_minus1proton2sodium,280.203844756,CGBOQYJQRLRGIE,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 4403,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,GHMRGLKPQJPFCD-DJIMGWMZSA-N,"InChI=1S/C17H28O3/c1-12(2)7-6-8-14(4)17(19)10-9-13(3)11-16(17)20-15(5)18/h7,11,14,16,19H,6,8-10H2,1-5H3/t14-,16-,17-/m1/s1",CC(=O)O[C@@H]1C=C(C)CC[C@@]1(O)[C@H](C)CCC=C(C)C,C17H28O3,pos_1_minus1proton2sodium,280.203844756,GHMRGLKPQJPFCD,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4404,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,GHMRGLKPQJPFCD-DJIMGWMZSA-N,"InChI=1S/C17H28O3/c1-12(2)7-6-8-14(4)17(19)10-9-13(3)11-16(17)20-15(5)18/h7,11,14,16,19H,6,8-10H2,1-5H3/t14-,16-,17-/m1/s1",CC(=O)O[C@@H]1C=C(C)CC[C@@]1(O)[C@H](C)CCC=C(C)C,C17H28O3,pos_1_minus1proton2sodium,280.203844756,GHMRGLKPQJPFCD,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 4405,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,DWBIYQVLFODAMM-JWQALPOXSA-N,"InChI=1S/C17H28O3/c1-11-5-6-15-14(11)9-13-7-8-16(15,3)20-17(13,4)10-19-12(2)18/h11,13-15H,5-10H2,1-4H3/t11-,13-,14-,15-,16+,17-/m1/s1",CC(=O)OC[C@@]1(C)O[C@@]2(C)CC[C@@H]1C[C@@H]1[C@H](C)CC[C@H]12,C17H28O3,pos_1_minus1proton2sodium,280.203844756,DWBIYQVLFODAMM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4406,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,RAPAFGOPSFDECW-CKQPZERJSA-N,"InChI=1S/C17H28O3/c1-10-6-7-17(19)15(3,4)13-8-12(10)16(17,5)9-14(13)20-11(2)18/h10,12-14,19H,6-9H2,1-5H3/t10-,12-,13-,14-,16-,17+/m0/s1",CC(=O)O[C@H]1C[C@@]2(C)[C@H]3C[C@@H]1C(C)(C)[C@]2(O)CC[C@@H]3C,C17H28O3,pos_1_minus1proton2sodium,280.203844756,RAPAFGOPSFDECW,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4407,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,RAPAFGOPSFDECW-UCDKGCPTSA-N,"InChI=1S/C17H28O3/c1-10-6-7-17(19)15(3,4)13-8-12(10)16(17,5)9-14(13)20-11(2)18/h10,12-14,19H,6-9H2,1-5H3/t10-,12-,13-,14+,16-,17+/m0/s1",CC(=O)O[C@@H]1C[C@@]2(C)[C@H]3C[C@@H]1C(C)(C)[C@]2(O)CC[C@@H]3C,C17H28O3,pos_1_minus1proton2sodium,280.203844756,RAPAFGOPSFDECW,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4408,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,RAPAFGOPSFDECW-UCDKGCPTSA-N,"InChI=1S/C17H28O3/c1-10-6-7-17(19)15(3,4)13-8-12(10)16(17,5)9-14(13)20-11(2)18/h10,12-14,19H,6-9H2,1-5H3/t10-,12-,13-,14+,16-,17+/m0/s1",CC(=O)O[C@@H]1C[C@@]2(C)[C@H]3C[C@@H]1C(C)(C)[C@]2(O)CC[C@@H]3C,C17H28O3,pos_1_minus1proton2sodium,280.203844756,RAPAFGOPSFDECW,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 4409,4287,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,ODJYOWOONQGNHL-ANCINPQNSA-N,"InChI=1S/C17H28O3/c1-10-13-8-12-6-7-17(5,20-16(12,3)4)14(13)9-15(10)19-11(2)18/h10,12-15H,6-9H2,1-5H3/t10-,12-,13+,14+,15-,17+/m0/s1",CC(=O)O[C@H]1C[C@@H]2[C@H](C[C@@H]3CC[C@@]2(C)OC3(C)C)[C@@H]1C,C17H28O3,pos_1_minus1proton2sodium,280.203844756,ODJYOWOONQGNHL,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4410,4285,471,Shikimates and Phenylpropanoids,Monoterpenoids,Simple phenolic acids,0.536762,ISDB,FFIHXENRVXVAGQ-UVLSWTAMSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11+,13-,14-/m1/s1",CC/C=C1/C=CC(=O)[C@@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Curvularia pallescens,868065.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Cochliobolus'],['Pseudocochliobolus pallescens'],1,0,3.147047996520996 4411,4285,471,Shikimates and Phenylpropanoids,Monoterpenoids,Simple phenolic acids,0.536762,ISDB,FFIHXENRVXVAGQ-UVLSWTAMSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11+,13-,14-/m1/s1",CC/C=C1/C=CC(=O)[C@@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Staphylotrichum coccosporum,630050.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Sordariales'],['Chaetomiaceae'],['Unknown'],['Staphylotrichum'],['Staphylotrichum coccosporum'],1,0,3.147047996520996 4412,4285,471,Shikimates and Phenylpropanoids,Monoterpenoids,Simple phenolic acids,0.536762,ISDB,FFIHXENRVXVAGQ-KZZKGCKGSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1",CC/C=C1/C=CC(=O)[C@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Drechslera,432344.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Drechslera'],['Unknown'],1,0,3.147047996520996 4413,4285,471,Shikimates and Phenylpropanoids,Monoterpenoids,Simple phenolic acids,0.536762,ISDB,FFIHXENRVXVAGQ-KZZKGCKGSA-N,"InChI=1S/C14H19NO6/c1-4-5-8-6-7-9(16)10(17)14(8)11(18)13(2,20)15(21-3)12(14)19/h5-7,10-11,17-18,20H,4H2,1-3H3/b8-5-/t10-,11-,13+,14+/m0/s1",CC/C=C1/C=CC(=O)[C@H](O)[C@]12C(=O)N(OC)[C@](C)(O)[C@@H]2O,C14H19NO6,,297.121237328,FFIHXENRVXVAGQ,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,Pyrenophora tritici-repentis,85506.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Pyrenophora'],['Pyrenophora tritici-repentis'],1,0,3.147047996520996 4414,4284,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.33046615,ISDB,QFDYIDGUKXRPKH-VSLGLSMXSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,42H,6-7,9,11-13,18-19,24-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC,C44H78NO8P,,779.546505086,QFDYIDGUKXRPKH,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,3.821864604949951 4415,4284,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.33046615,ISDB,QFDYIDGUKXRPKH-VSLGLSMXSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,42H,6-7,9,11-13,18-19,24-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC,C44H78NO8P,,779.546505086,QFDYIDGUKXRPKH,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,3.821864604949951 4416,4282,912,,,,0.31549424,ISDB,,,,,,,MYNVMBICAGQOMG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.261976957321167 4417,4281,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_2MHNH3,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,1,7.5 4418,4279,-1,,,,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-O,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17+,18+,19-,21?/m1/s1",OC[C@H]1OC(Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O,C21H21O11+,pos_2MH,449.10783791209,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caucasica,5746390.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caucasica'],8,0,8.0 4419,4278,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.0,MS1_match,ZEIIWKCRPSSDKR-UHFFFAOYSA-N,"InChI=1S/C27H35NO13/c1-3-16-17(7-6-14-9-15(24(35)36)11-28(10-14)8-4-5-20(30)31)18(25(37)38-2)13-39-26(16)41-27-23(34)22(33)21(32)19(12-29)40-27/h3,6-7,9,11,13,16-17,19,21-23,26-27,29,32-34H,1,4-5,8,10,12H2,2H3,(H,30,31)(H,35,36)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=CN(CCCC(=O)O)C1,C27H35NO13,pos_2_2proton1acetonitrile,581.21084018,ZEIIWKCRPSSDKR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4420,4276,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4421,4276,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4422,4276,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 4423,4276,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_1_1proton1ammonium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 4424,4274,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.47407204,ISDB,MYQAIYGVAHDZRD-JUIQTESCSA-N,"InChI=1S/C29H44O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-11,13,19-21,23,25,27,30H,7,12,14-18H2,1-6H3/b9-8+/t20-,21-,23+,25-,27+,28+,29-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CC=C2C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(C)C,C29H44O,,408.339216028,MYQAIYGVAHDZRD,Terpenoids,Steroids,Ergostane steroids,Actinidia chinensis var. deliciosa,279986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Actinidiaceae'],['Unknown'],['Actinidia'],['Actinidia deliciosa'],4,1,6.396288156509399 4425,4273,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton1ammonium,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4426,4273,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton1ammonium,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4427,4270,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.2754702,ISDB,JQTRPSHLFTZYHC-SESVXGAZSA-N,"InChI=1S/C23H29NO2/c1-20(2)18(25)10-11-21(3)22(4)14(9-12-23(20,21)26)13-16-15-7-5-6-8-17(15)24-19(16)22/h5-8,14,24,26H,9-13H2,1-4H3/t14-,21+,22+,23+/m0/s1",CC1(C)C(=O)CC[C@]2(C)[C@@]3(C)c4[nH]c5ccccc5c4C[C@@H]3CC[C@@]12O,C23H29NO2,,351.21982916800005,JQTRPSHLFTZYHC,Alkaloids,Tryptophan alkaloids,Indole-Diterpenoid alkaloids (Penitrems),Akanthomyces lecanii,212411.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Cordycipitaceae'],['Unknown'],['Lecanicillium'],['Lecanicillium lecanii'],1,0,2.1018807888031006 4428,4269,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_1proton,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4429,4266,-1,,,,0.50794584,ISDB,SFAHCAMKUIRNCU-DMEHNAEFSA-N,"InChI=1S/C14H17NO7/c16-5-8-9(17)10(18)11(19)12(22-8)13-14(20)15-6-3-1-2-4-7(6)21-13/h1-4,8-13,16-19H,5H2,(H,15,20)/t8-,9-,10+,11-,12?,13-/m1/s1",O=C1Nc2ccccc2O[C@@H]1C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C14H17NO7,,311.100501884,SFAHCAMKUIRNCU,Alkaloids,,,Ruellia tuberosa,390453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Acanthaceae'],['Ruellieae'],['Ruellia'],['Ruellia tuberosa'],4,0,6.03178334236145 4430,4265,-1,,,,0.0,MS1_match,CCRXMHCQWYVXTE-AWALXHGNSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24+,25+,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,43-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O18,pos_1_sodium,928.503165592,CCRXMHCQWYVXTE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4431,4265,-1,,,,0.0,MS1_match,CCRXMHCQWYVXTE-AWALXHGNSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24+,25+,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,43-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O18,pos_1_sodium,928.503165592,CCRXMHCQWYVXTE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4432,4262,-1,,,,0.0,MS1_match,RROGHRHLBLVQSG-ZIEWLMKPSA-N,"InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)53-34-32(28(45)23(44)19-51-34)54-33-31(48)30(47)29(46)24(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32-,33-,34-,37-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O13,pos_1_sodium,766.450342172,RROGHRHLBLVQSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4433,4262,-1,,,,0.0,MS1_match,RROGHRHLBLVQSG-ZIEWLMKPSA-N,"InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)53-34-32(28(45)23(44)19-51-34)54-33-31(48)30(47)29(46)24(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32-,33-,34-,37-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O13,pos_1_sodium,766.450342172,RROGHRHLBLVQSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4434,4259,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5245799,ISDB,CMXCLTFHXRTSPB-WIXFNSMHSA-N,"InChI=1S/C30H44O2/c1-18(2)9-7-10-19(3)23-14-22-16-30(25(23)13-21(22)5)26-15-24-20(4)11-8-12-29(24,6)17-27(26)32-28(30)31/h9,13,15,19-20,22-23,25-27H,7-8,10-12,14,16-17H2,1-6H3/t19-,20-,22+,23-,25-,26-,27+,29+,30-/m0/s1",CC(C)=CCC[C@H](C)[C@@H]1C[C@@H]2C[C@]3(C(=O)O[C@@H]4C[C@@]5(C)CCC[C@H](C)C5=C[C@@H]43)[C@H]1C=C2C,C30H44O2,,436.334130648,CMXCLTFHXRTSPB,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Helenium autumnale,483908.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Helenium'],['Helenium autumnale'],4,2,7.0983195304870605 4435,4254,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MHNH3,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 4436,4254,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MHNH3,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 4437,4254,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_2MHNH3,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,2,8.0 4438,4254,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MHNH3,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 4439,4254,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_2MHNH3,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 4440,4254,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_2MHNH3,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,2,8.0 4441,4252,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,3,9.5 4442,4252,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-UHFFFAOYSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)",O=C(O)C=Cc1ccc(O)c(O)c1,C9H8O4,pos_1_1proton,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 4443,4251,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIUOVIRIFZOCLL-UHFFFAOYSA-N,"InChI=1S/C12H10O4/c1-8(14)16-6-10-5-15-7-12-9(4-13)2-3-11(10)12/h2-5,7H,6H2,1H3",CC(=O)OCc1cocc2c(C=O)ccc1-2,C12H10O4,pos_1_1proton1ammonium,218.0579088,QIUOVIRIFZOCLL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 4444,4251,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIUOVIRIFZOCLL-UHFFFAOYSA-N,"InChI=1S/C12H10O4/c1-8(14)16-6-10-5-15-7-12-9(4-13)2-3-11(10)12/h2-5,7H,6H2,1H3",CC(=O)OCc1cocc2c(C=O)ccc1-2,C12H10O4,pos_1_1proton1ammonium,218.0579088,QIUOVIRIFZOCLL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 4445,4251,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIUOVIRIFZOCLL-UHFFFAOYSA-N,"InChI=1S/C12H10O4/c1-8(14)16-6-10-5-15-7-12-9(4-13)2-3-11(10)12/h2-5,7H,6H2,1H3",CC(=O)OCc1cocc2c(C=O)ccc1-2,C12H10O4,pos_1_1proton1ammonium,218.0579088,QIUOVIRIFZOCLL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 4446,4251,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIUOVIRIFZOCLL-UHFFFAOYSA-N,"InChI=1S/C12H10O4/c1-8(14)16-6-10-5-15-7-12-9(4-13)2-3-11(10)12/h2-5,7H,6H2,1H3",CC(=O)OCc1cocc2c(C=O)ccc1-2,C12H10O4,pos_1_1proton1ammonium,218.0579088,QIUOVIRIFZOCLL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 4447,4250,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,LSWIQAFXJMEWTA-UHFFFAOYSA-N,"InChI=1S/C16H20O4/c1-5-12(2)16(17)20-10-6-7-13-8-9-14(18-3)15(11-13)19-4/h5-9,11H,10H2,1-4H3",CC=C(C)C(=O)OCC=Cc1ccc(OC)c(OC)c1,C16H20O4,pos_1_1proton1ammonium,276.13615912,LSWIQAFXJMEWTA,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,2,7.0 4448,4248,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.28734055,ISDB,JSXCGBWUPLORSN-UHFFFAOYSA-N,"InChI=1S/C35H54O7/c1-19-25-20-8-9-23-31(4)12-11-24(41-28-27(38)26(37)21(36)18-40-28)30(2,3)22(31)10-13-33(23,6)32(20,5)14-16-35(25)17-15-34(19,7)42-29(35)39/h8,19,21-28,36-38H,9-18H2,1-7H3",CC1C2C3=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CCC23CCC1(C)OC3=O,C35H54O7,,586.3869540679999,JSXCGBWUPLORSN,Terpenoids,Triterpenoids,Oleanane triterpenoids,Rosa laevigata,383273.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa laevigata'],4,3,6.649362206459045 4449,4247,653,Terpenoids,Diterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGWXCNUGXLABMC-UHFFFAOYSA-N,"InChI=1S/C10H12O4/c1-4-5-3-6(11)10(2)7(5)8(12)13-9(4)14-10/h5-7,9,11H,1,3H2,2H3",C=C1C2OC(=O)C3C1CC(O)C3(C)O2,C10H12O4,pos_1_1proton1acetonitrile,196.073558864,BGWXCNUGXLABMC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 4450,4246,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_2MH,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,3,9.5 4451,4246,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_2MH,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,3,9.5 4452,4245,-1,,,,0.45373517,ISDB,IAIGXJKNILCTLY-NOKYZJAZSA-N,"InChI=1S/C20H25FO5/c1-9-10-4-5-11-19(8-10,15(9)21)13(16(23)25-3)14-18(2)12(22)6-7-20(11,14)26-17(18)24/h10-15,22H,1,4-8H2,2-3H3/t10-,11-,12+,13-,14-,15+,18-,19-,20-/m1/s1",C=C1[C@@H]2CC[C@H]3[C@@]45CC[C@H](O)[C@@](C)(C(=O)O4)[C@H]5[C@H](C(=O)OC)[C@]3(C2)[C@H]1F,C20H25FO5,,364.16860212,IAIGXJKNILCTLY,Terpenoids,Diterpenoids,Gibberellins,Fusarium fujikuroi,1067425.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Nectriaceae'],['Unknown'],['Fusarium'],['Fusarium fujikuroi'],1,0,2.8149406909942627 4453,4245,-1,,,,0.45373517,ISDB,IAIGXJKNILCTLY-UHFFFAOYSA-N,"InChI=1S/C20H25FO5/c1-9-10-4-5-11-19(8-10,15(9)21)13(16(23)25-3)14-18(2)12(22)6-7-20(11,14)26-17(18)24/h10-15,22H,1,4-8H2,2-3H3",C=C1C2CCC3C45CCC(O)C(C)(C(=O)O4)C5C(C(=O)OC)C3(C2)C1F,C20H25FO5,,364.16860212,IAIGXJKNILCTLY,Terpenoids,Diterpenoids,Gibberellins,Gibberella fujikuroi,584890.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Nectriaceae'],['Unknown'],['Gibberella'],['Gibberella fujikuroi'],1,0,2.8149406909942627 4454,4244,764,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.0,MS1_match,SECXISVLQFMRJM-UHFFFAOYSA-N,"InChI=1S/C5H9NO/c1-6-4-2-3-5(6)7/h2-4H2,1H3",CN1CCCC1=O,C5H9NO,pos_1_1proton1methanol,99.068413908,SECXISVLQFMRJM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,3,7.5 4455,4243,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.2255192,ISDB,LANWWIQLMZOPKM-FPYGCLRLSA-N,"InChI=1S/C16H21NO5/c1-11(19)3-8-15(20)14(9-16(21)22-2)17-13-6-4-12(10-18)5-7-13/h3-8,10-11,14-15,17,19-20H,9H2,1-2H3/b8-3+",COC(=O)CC(Nc1ccc(C=O)cc1)C(O)/C=C/C(C)O,C16H21NO5,,307.141972772,LANWWIQLMZOPKM,,,,Streptomyces viridochromogenes,676476.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Streptomyces viridochromogenes'],0,0,0.902076780796051 4456,4242,471,Shikimates and Phenylpropanoids,Monoterpenoids,Simple phenolic acids,0.0,MS1_match,HCGUNEDCTVLVNP-HVLDEAOBSA-N,"InChI=1S/C27H38O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h10-11,13,15-16,21,25-26,32H,8-9,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H38O10,pos_2_2sodium,522.2464974159999,HCGUNEDCTVLVNP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,2,7.0 4457,4241,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.46207538,ISDB,HXFVBMHVQDXIOG-UHFFFAOYSA-N,"InChI=1S/C36H36O18/c37-13-25-28(43)30(45)32(47)35(53-25)51-23-11-18(39)10-22-19(23)12-24(34(50-22)16-3-5-17(38)6-4-16)52-36-33(48)31(46)29(44)26(54-36)14-49-27(42)8-2-15-1-7-20(40)21(41)9-15/h1-12,25-26,28-33,35-37,39-41,43-48H,13-14H2",O=C1C=CC(=C2Oc3cc(O)cc(OC4OC(CO)C(O)C(O)C4O)c3C=C2OC2OC(COC(=O)C=Cc3ccc(O)c(O)c3)C(O)C(O)C2O)C=C1,C36H36O18,,756.190164312,HXFVBMHVQDXIOG,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Salvia splendens,294217.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia splendens'],4,2,6.848301529884338 4458,4241,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.46207538,ISDB,HXFVBMHVQDXIOG-UHFFFAOYSA-N,"InChI=1S/C36H36O18/c37-13-25-28(43)30(45)32(47)35(53-25)51-23-11-18(39)10-22-19(23)12-24(34(50-22)16-3-5-17(38)6-4-16)52-36-33(48)31(46)29(44)26(54-36)14-49-27(42)8-2-15-1-7-20(40)21(41)9-15/h1-12,25-26,28-33,35-37,39-41,43-48H,13-14H2",O=C1C=CC(=C2Oc3cc(O)cc(OC4OC(CO)C(O)C(O)C4O)c3C=C2OC2OC(COC(=O)C=Cc3ccc(O)c(O)c3)C(O)C(O)C2O)C=C1,C36H36O18,,756.190164312,HXFVBMHVQDXIOG,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Hyacinthus orientalis,712150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hyacinthaceae'],['Hyacintheae'],['Hyacinthus'],['Hyacinthus orientalis'],4,2,6.848301529884338 4459,4240,433,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.3336905,ISDB,UQTIXOCPRRVPGA-ZDUSSCGKSA-N,"InChI=1S/C14H15NO5/c1-9(17)20-7-13-12-5-10(19-2)6-14(18)11(12)3-4-15(13)8-16/h3-6,8,13,18H,7H2,1-2H3/t13-/m0/s1",COc1cc(O)c2c(c1)[C@H](COC(C)=O)N(C=O)C=C2,C14H15NO5,,277.09502258,UQTIXOCPRRVPGA,Alkaloids,,,Neopetrosia similis,4939026.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Haplosclerida'],['Petrosiidae'],['Unknown'],['Neopetrosia'],['Neopetrosia similis'],1,1,2.8347619771957397 4460,4239,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,PREKJVTWKHSPSU-SPDAVFANSA-N,"InChI=1S/C36H36O19/c37-12-25-29(45)30(46)32(48)35(53-25)50-13-26-34(55-27(44)6-2-14-1-4-17(38)19(40)7-14)31(47)33(49)36(54-26)51-16-9-21(42)28-22(43)11-23(52-24(28)10-16)15-3-5-18(39)20(41)8-15/h1-11,25-26,29-42,45-49H,12-13H2/b6-2+/t25-,26-,29-,30+,31-,32-,33-,34-,35-,36-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c2)O[C@@H]1CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C36H36O19,pos_1_1proton,772.185078932,PREKJVTWKHSPSU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 4461,4239,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,LUGJNXFXIGAHTI-SPDAVFANSA-N,"InChI=1S/C36H36O19/c37-12-25-34(55-27(44)6-2-14-1-4-17(38)19(40)7-14)31(47)33(49)35(53-25)50-13-26-29(45)30(46)32(48)36(54-26)51-16-9-21(42)28-22(43)11-23(52-24(28)10-16)15-3-5-18(39)20(41)8-15/h1-11,25-26,29-42,45-49H,12-13H2/b6-2+/t25-,26-,29-,30+,31-,32-,33-,34-,35-,36-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)[C@H](O)[C@@H](O)[C@@H]2O)O[C@@H]1CO,C36H36O19,pos_1_1proton,772.185078932,LUGJNXFXIGAHTI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 4462,4238,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.29680666,ISDB,RZZOZECFGLWGQV-UHFFFAOYSA-N,"InChI=1S/C16H17NO3/c1-20-13-8-6-12(7-9-13)10-11-17-16(19)14-4-2-3-5-15(14)18/h2-9,18H,10-11H2,1H3,(H,17,19)",COc1ccc(CCNC(=O)c2ccccc2O)cc1,C16H17NO3,,271.120843404,RZZOZECFGLWGQV,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Aniba riparia,6025354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Aniba'],['Aniba riparia'],4,3,6.68722665309906 4463,4236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RPMNUQRUHXIGHK-UHFFFAOYSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O14,pos_1_1proton,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,8.0 4464,4236,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RPMNUQRUHXIGHK-PYXJVEIZSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1proton,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 4465,4235,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RJKFOVLPORLFTN-LEKSSAKUSA-N,"InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1",CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,C21H30O2,pos_2_2sodium,314.2245802,RJKFOVLPORLFTN,Terpenoids,Steroids,Pregnane steroids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,1,8.5 4466,4233,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.30625948,ISDB,GUZAIURHRDPBKE-HIEJAJBWSA-N,"InChI=1S/C30H46O3/c1-17(2)18-9-12-22-29(18,7)25(33)16-28(6)19-10-11-21-26(3,4)23(31)13-14-27(21,5)20(19)15-24(32)30(22,28)8/h10,15,17-18,21-23,25,31,33H,9,11-14,16H2,1-8H3/t18-,21+,22-,23-,25-,27-,28-,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC(=O)[C@@]21C,C30H46O3,,454.344695332,GUZAIURHRDPBKE,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,9.225037932395935 4467,4232,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,DHPIOVHVFXYRTA-MGRUWCHMSA-N,"InChI=1S/C33H40O8/c1-35-26-13-10-21(16-29(26)38-4)8-7-9-23-17-25(32(34)22-11-14-27(36-2)30(18-22)39-5)20-41-33(23)24-12-15-28(37-3)31(19-24)40-6/h7-8,10-16,18-19,23,25,32-34H,9,17,20H2,1-6H3/b8-7+/t23-,25+,32?,33-/m1/s1",COc1ccc(/C=C/C[C@@H]2C[C@H](C(O)c3ccc(OC)c(OC)c3)CO[C@H]2c2ccc(OC)c(OC)c2)cc1OC,C33H40O8,pos_2_1proton1sodium,564.27231824,DHPIOVHVFXYRTA,Shikimates and Phenylpropanoids,Lignans,Neolignans,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,1,6.5 4468,4231,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CDVGDLGBEAICDA-UHFFFAOYSA-N,"InChI=1S/C23H34O15/c1-3-8-9(4-13-33-7-12-19(37-13)16(27)17(28)21(31)35-12)10(20(30)32-2)6-34-22(8)38-23-18(29)15(26)14(25)11(5-24)36-23/h3,6,8-9,11-19,21-29,31H,1,4-5,7H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1OCC2OC(O)C(O)C(O)C2O1,C23H34O15,pos_1_1proton1ammonium,550.189770388,CDVGDLGBEAICDA,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 4469,4230,-1,,,,0.87564385,ISDB,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,0,11.502575397491455 4470,4230,-1,,,,0.87564385,ISDB,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,11.502575397491455 4471,4230,-1,,,,0.87564385,ISDB,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,11.502575397491455 4472,4229,-1,,,,0.0,MS1_match,GGFAHFSRIITJIJ-NONSRLQASA-N,"InChI=1S/C11H16O4/c1-6-3-4-7-8(10(12)14-2)5-15-11(13)9(6)7/h5-7,9,11,13H,3-4H2,1-2H3/t6-,7+,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@H]2[C@@H]1CC[C@@H]2C,C11H16O4,pos_1_1proton1acetonitrile,212.104858992,GGFAHFSRIITJIJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4473,4228,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.378723,ISDB,RXLNMWFWITXARW-UHFFFAOYSA-N,"InChI=1S/C13H13NO5/c1-15-8-5-4-7-9(11(8)17-3)14-13-12(10(7)16-2)18-6-19-13/h4-5H,6H2,1-3H3",COc1ccc2c(OC)c3c(nc2c1OC)OCO3,C13H13NO5,,263.079372516,RXLNMWFWITXARW,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Acanthosyris paulo-alvinii,6041911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Santalales'],['Santalaceae'],['Unknown'],['Acanthosyris'],['Acanthosyris paulo-alvinii'],4,3,7.014891982078552 4474,4227,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4475,4227,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 4476,4227,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4477,4227,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 4478,4226,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.27140766,ISDB,BFSRJRKZZSIEFP-MOHLSBLISA-N,"InChI=1S/C30H46O2/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-20-25(3,4)23(31)10-11-26(20,5)21(27)9-13-30(28,32-19-29)22(29)18-24/h9,13,20-22H,8,10-12,14-19H2,1-7H3/t20-,21-,22-,26+,27-,28+,29-,30-/m1/s1",CC1(C)CC[C@@]23CC[C@@]4(C)[C@]5(C)CC[C@@H]6C(C)(C)C(=O)CC[C@]6(C)[C@H]5C=C[C@@]4(OC2)[C@@H]3C1,C30H46O2,,438.349780712,BFSRJRKZZSIEFP,Terpenoids,Triterpenoids,Oleanane triterpenoids,Viburnum odoratissimum var. awabuki,90825.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum awabuki'],5,3,7.585630655288696 4479,4225,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2687744,ISDB,RROGHRHLBLVQSG-ZIEWLMKPSA-N,"InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)53-34-32(28(45)23(44)19-51-34)54-33-31(48)30(47)29(46)24(18-42)52-33/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32-,33-,34-,37-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O13,,766.450342172,RROGHRHLBLVQSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,10.575097560882568 4480,4224,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.21606264,ISDB,,,,,,,XNOBKDCGNGFVSV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8642505407333374 4481,4223,653,Terpenoids,Diterpenoids,Iridoids monoterpenoids,0.35499454,ISDB,QOJMEKKFSSPMRF-RKQHYHRCSA-N,"InChI=1S/C14H17NO6/c15-6-5-8-1-3-9(4-2-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-4,10-14,16-19H,5,7H2/t10-,11-,12+,13-,14-/m1/s1",N#CCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C14H17NO6,,295.105587264,QOJMEKKFSSPMRF,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Hydrangea macrophylla,162001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea macrophylla'],4,0,5.419978141784668 4482,4222,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.5169046,ISDB,BVKKHPBKRVEHGR-UHFFFAOYSA-N,"InChI=1S/C10H10O3/c11-5-6-4-9(12)10(13)8-3-1-2-7(6)8/h4-5,12-13H,1-3H2",O=Cc1cc(O)c(O)c2c1CCC2,C10H10O3,,178.06299418,BVKKHPBKRVEHGR,Terpenoids,,,Amomum tsao-ko,698763.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Lanxangia'],['Lanxangia tsaoko'],4,1,6.567618370056152 4483,4222,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.5169046,ISDB,BVKKHPBKRVEHGR-UHFFFAOYSA-N,"InChI=1S/C10H10O3/c11-5-6-4-9(12)10(13)8-3-1-2-7(6)8/h4-5,12-13H,1-3H2",O=Cc1cc(O)c(O)c2c1CCC2,C10H10O3,,178.06299418,BVKKHPBKRVEHGR,Terpenoids,,,Lanxangia tsao-ko,698763.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Lanxangia'],['Lanxangia tsaoko'],4,1,6.567618370056152 4484,4221,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_sodium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4485,4221,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_sodium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4486,4221,-1,,,,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_sodium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4487,4220,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RRAFCDWBNXTKKO-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3",C=CCc1ccc(O)c(OC)c1,C10H12O2,pos_1_1proton1acetonitrile,164.083729624,RRAFCDWBNXTKKO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4488,4220,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LREHGXOCZVBABG-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-5-8-6-4-7-9(12-2)10(8)11/h3-4,6-7,11H,1,5H2,2H3",C=CCc1cccc(OC)c1O,C10H12O2,pos_1_1proton1acetonitrile,164.083729624,LREHGXOCZVBABG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4489,4219,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_sodium,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4490,4219,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-XAMQMYJNSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23+,24+,25-,26+,27-,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_sodium,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 4491,4217,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_2MNa,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 4492,4217,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_2MNa,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 4493,4217,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_2MNa,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 4494,4217,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_2MNa,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 4495,4216,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,DRAPQDCEBKBPQE-ACFZRETJSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(13-4-6-16(29)18(8-13)34-2)26(14,11-36-23)38-25-22(32)21(31)20(30)19(9-27)37-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25+,26-/m1/s1",COc1cc([C@H]2OC[C@]3(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639999,DRAPQDCEBKBPQE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4496,4216,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4497,4216,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4498,4216,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,GQLQVPZSTWXDBQ-ZOKOZUFBSA-N,"InChI=1S/C26H32O12/c1-33-17-8-13(3-5-15(17)28)24-26(32)11-36-23(14(26)10-35-24)12-4-6-16(18(7-12)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25-,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639998,GQLQVPZSTWXDBQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 4499,4216,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.0,MS1_match,KPZWNZOLVDRTMM-YRDWWIAGSA-N,"InChI=1S/C26H32O12/c1-33-18-8-13(3-5-16(18)28)23-26(32)11-36-22(15(26)10-35-23)12-4-6-17(19(7-12)34-2)37-25-14(9-27)20(29)21(30)24(31)38-25/h3-8,14-15,20-25,27-32H,9-11H2,1-2H3/t14-,15-,20-,21+,22-,23-,24+,25+,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@H]5O[C@H](O)[C@@H](O)[C@H](O)[C@H]5CO)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,KPZWNZOLVDRTMM,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 4500,4215,529,Alkaloids,,,0.57621825,ISDB,KOGLPFSKEKZVCZ-WCQYABFASA-N,"InChI=1S/C15H17NO5/c1-15(2)13(18)11(17)9-12(21-15)7-5-4-6-8(20-3)10(7)16-14(9)19/h4-6,11,13,17-18H,1-3H3,(H,16,19)/t11-,13+/m0/s1",COc1cccc2c3c(c(O)nc12)[C@H](O)[C@@H](O)C(C)(C)O3,C15H17NO5,,291.110672644,KOGLPFSKEKZVCZ,Alkaloids,,,Rauia resinosa,6126588.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Rauia'],['Rauia resinosa'],4,1,6.804872989654541 4501,4213,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_1proton1ammonium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4502,4213,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NXJMINIPVKJRHD-CXGIBTINSA-N,"InChI=1S/C47H76O17/c1-22-30(51)33(54)35(56)38(60-22)63-37-31(52)25(50)20-59-40(37)62-29-11-12-43(4)27(44(29,5)21-49)10-13-46(7)28(43)9-8-23-24-18-42(2,3)14-16-47(24,17-15-45(23,46)6)41(58)64-39-36(57)34(55)32(53)26(19-48)61-39/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O17,pos_1_1proton1ammonium,912.5082509720004,NXJMINIPVKJRHD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4503,4213,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,NFIQKUQYFSTGFU-VWZQPUASSA-N,"InChI=1S/C47H76O17/c1-42(2)14-16-47(41(58)64-40-37(57)34(54)32(52)26(62-40)21-60-38-36(56)33(53)31(51)25(19-48)61-38)17-15-45(6)22(23(47)18-42)8-9-28-44(5)12-11-29(43(3,4)27(44)10-13-46(28,45)7)63-39-35(55)30(50)24(49)20-59-39/h8,23-40,48-57H,9-21H2,1-7H3/t23-,24-,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38+,39-,40-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O17,pos_1_1proton1ammonium,912.5082509720002,NFIQKUQYFSTGFU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4504,4212,-1,,,,0.23129375,ISDB,QEGAWOPOQXLXMR-UCLAKJBNSA-N,"InChI=1S/C11H14O6/c1-15-8(12)6-5-2-3-11(14)4-16-10(7(5)11)17-9(6)13/h2-3,5-7,9-10,13-14H,4H2,1H3/t5-,6-,7-,9+,10+,11-/m1/s1",COC(=O)[C@H]1[C@H]2C=C[C@@]3(O)CO[C@@H](O[C@@H]1O)[C@@H]23,C11H14O6,,242.079038168,QEGAWOPOQXLXMR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Viburnum cylindricum,205162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum cylindricum'],5,0,5.9251750111579895 4505,4210,433,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.6941266,ISDB,RYVHAUGLXQMZCK-UHFFFAOYSA-N,"InChI=1S/C13H15NO4/c1-4-7-11(17-2)8-5-6-9(15)12(18-3)10(8)14-13(7)16/h5-6,15H,4H2,1-3H3,(H,14,16)",CCc1c(O)nc2c(OC)c(O)ccc2c1OC,C13H15NO4,,249.10010796,RYVHAUGLXQMZCK,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum acutifolium,239196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum acutifolium'],4,3,8.276506423950195 4506,4209,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.26734576,ISDB,BFSRJRKZZSIEFP-MOHLSBLISA-N,"InChI=1S/C30H46O2/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-20-25(3,4)23(31)10-11-26(20,5)21(27)9-13-30(28,32-19-29)22(29)18-24/h9,13,20-22H,8,10-12,14-19H2,1-7H3/t20-,21-,22-,26+,27-,28+,29-,30-/m1/s1",CC1(C)CC[C@@]23CC[C@@]4(C)[C@]5(C)CC[C@@H]6C(C)(C)C(=O)CC[C@]6(C)[C@H]5C=C[C@@]4(OC2)[C@@H]3C1,C30H46O2,,438.349780712,BFSRJRKZZSIEFP,Terpenoids,Triterpenoids,Oleanane triterpenoids,Viburnum odoratissimum var. awabuki,90825.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum awabuki'],5,3,7.569383025169373 4507,4208,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.4803054,ISDB,CMXCLTFHXRTSPB-WIXFNSMHSA-N,"InChI=1S/C30H44O2/c1-18(2)9-7-10-19(3)23-14-22-16-30(25(23)13-21(22)5)26-15-24-20(4)11-8-12-29(24,6)17-27(26)32-28(30)31/h9,13,15,19-20,22-23,25-27H,7-8,10-12,14,16-17H2,1-6H3/t19-,20-,22+,23-,25-,26-,27+,29+,30-/m0/s1",CC(C)=CCC[C@H](C)[C@@H]1C[C@@H]2C[C@]3(C(=O)O[C@@H]4C[C@@]5(C)CCC[C@H](C)C5=C[C@@H]43)[C@H]1C=C2C,C30H44O2,,436.334130648,CMXCLTFHXRTSPB,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Helenium autumnale,483908.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Helenium'],['Helenium autumnale'],4,2,6.921221613883972 4508,4207,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QRGSTISKDZCDHV-XCVCLJGOSA-N,"InChI=1S/C12H14O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h3-8H,9H2,1-2H3/b10-3+",C/C=C(\C)C(=O)OCc1ccccc1,C12H14O2,pos_1_1proton1ammonium,190.099379688,QRGSTISKDZCDHV,,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 4509,4205,155,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.3854187,ISDB,IGLFDZPSOHOIMY-UHFFFAOYSA-N,"InChI=1S/C15H19NO7/c1-21-10-6-8(4-5-16)2-3-9(10)22-15-14(20)13(19)12(18)11(7-17)23-15/h2-3,6,11-15,17-20H,4,7H2,1H3",COc1cc(CC#N)ccc1OC1OC(CO)C(O)C(O)C1O,C15H19NO7,,325.116151948,IGLFDZPSOHOIMY,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Hydrangea macrophylla,162001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea macrophylla'],4,0,5.541674852371216 4510,4204,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.43733513,ISDB,FMIMFCRXYXVFTA-FUAOEXFOSA-N,"InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-22H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O3,,454.344695332,FMIMFCRXYXVFTA,Terpenoids,Triterpenoids,Oleanane triterpenoids,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,3,10.249340534210205 4511,4203,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.529777,ISDB,CMXCLTFHXRTSPB-WIXFNSMHSA-N,"InChI=1S/C30H44O2/c1-18(2)9-7-10-19(3)23-14-22-16-30(25(23)13-21(22)5)26-15-24-20(4)11-8-12-29(24,6)17-27(26)32-28(30)31/h9,13,15,19-20,22-23,25-27H,7-8,10-12,14,16-17H2,1-6H3/t19-,20-,22+,23-,25-,26-,27+,29+,30-/m0/s1",CC(C)=CCC[C@H](C)[C@@H]1C[C@@H]2C[C@]3(C(=O)O[C@@H]4C[C@@]5(C)CCC[C@H](C)C5=C[C@@H]43)[C@H]1C=C2C,C30H44O2,,436.334130648,CMXCLTFHXRTSPB,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Helenium autumnale,483908.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Helenium'],['Helenium autumnale'],4,2,7.119107961654663 4512,4202,170,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.7899317,ISDB,RYVHAUGLXQMZCK-UHFFFAOYSA-N,"InChI=1S/C13H15NO4/c1-4-7-11(17-2)8-5-6-9(15)12(18-3)10(8)14-13(7)16/h5-6,15H,4H2,1-3H3,(H,14,16)",CCc1c(O)nc2c(OC)c(O)ccc2c1OC,C13H15NO4,,249.10010796,RYVHAUGLXQMZCK,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum acutifolium,239196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum acutifolium'],4,1,7.659726858139038 4513,4201,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4514,4201,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4515,4201,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,GXWUEMSASMVWKO-IRJHRTJJSA-N,"InChI=1S/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33-,34-,38-,39+,40+,41-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C41H66O12,pos_1_1proton1ammonium,750.455427552,GXWUEMSASMVWKO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4516,4200,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.33300343,ISDB,GUZAIURHRDPBKE-HIEJAJBWSA-N,"InChI=1S/C30H46O3/c1-17(2)18-9-12-22-29(18,7)25(33)16-28(6)19-10-11-21-26(3,4)23(31)13-14-27(21,5)20(19)15-24(32)30(22,28)8/h10,15,17-18,21-23,25,31,33H,9,11-14,16H2,1-8H3/t18-,21+,22-,23-,25-,27-,28-,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC(=O)[C@@]21C,C30H46O3,,454.344695332,GUZAIURHRDPBKE,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,9.332013726234436 4517,4199,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,CCRXMHCQWYVXTE-AWALXHGNSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24+,25+,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,43-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O18,pos_1_1proton1ammonium,928.503165592,CCRXMHCQWYVXTE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4518,4199,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,CCRXMHCQWYVXTE-AWALXHGNSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24+,25+,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,43-,44-,45+,46+,47-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O18,pos_1_1proton1ammonium,928.503165592,CCRXMHCQWYVXTE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,3,9.5 4519,4198,1838,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4520,4198,1838,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 4521,4198,1838,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4522,4198,1838,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 4523,4198,1838,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4524,4198,1838,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 4525,4197,801,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,ZYGHJZDHTFUPRJ-UHFFFAOYSA-N,InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,O=c1ccc2ccccc2o1,C9H6O2,pos_1_1proton,146.036779432,ZYGHJZDHTFUPRJ,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,3,7.5 4526,4196,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JUJTUEBXXGRSJB-MTAKFWDWSA-N,"InChI=1S/C17H26O9/c1-3-9-10-4-12(22-2)23-6-8(10)7-24-16(9)26-17-15(21)14(20)13(19)11(5-18)25-17/h3,7,9-21H,1,4-6H2,2H3/t9-,10-,11-,12-,13-,14+,15-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2CO[C@@H](OC)C[C@H]21,C17H26O9,pos_1_1proton1ammonium,374.1576824119999,JUJTUEBXXGRSJB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 4527,4193,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,KLBGJKBYPWKZDT-OBYWQNJGSA-N,"InChI=1S/C33H38O11/c1-20(34)40-19-32-25(41-21(2)35)13-15-31(5,38)33(32)28(43-29(37)23-14-16-39-18-23)24(30(3,4)44-33)17-26(32)42-27(36)12-11-22-9-7-6-8-10-22/h6-12,14,16,18,24-26,28,38H,13,15,17,19H2,1-5H3/b12-11+/t24-,25+,26+,28-,31+,32+,33+/m1/s1",CC(=O)OC[C@@]12[C@@H](OC(C)=O)CC[C@](C)(O)[C@]13OC(C)(C)[C@H](C[C@@H]2OC(=O)/C=C/c1ccccc1)[C@H]3OC(=O)c1ccoc1,C33H38O11,pos_1_1proton,610.241412036,KLBGJKBYPWKZDT,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,2,8.0 4528,4193,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,ZYDOFCQFZCENDE-PFUPTIRUSA-N,"InChI=1S/C33H38O11/c1-20(34)40-19-32-25(43-29(37)23-14-16-39-18-23)13-15-31(5,38)33(32)28(41-21(2)35)24(30(3,4)44-33)17-26(32)42-27(36)12-11-22-9-7-6-8-10-22/h6-12,14,16,18,24-26,28,38H,13,15,17,19H2,1-5H3/b12-11+/t24-,25+,26-,28-,31+,32+,33+/m1/s1",CC(=O)OC[C@@]12[C@@H](OC(=O)c3ccoc3)CC[C@](C)(O)[C@]13OC(C)(C)[C@H](C[C@H]2OC(=O)/C=C/c1ccccc1)[C@H]3OC(C)=O,C33H38O11,pos_1_1proton,610.241412036,ZYDOFCQFZCENDE,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,2,8.0 4529,4190,-1,,,,0.0,MS1_match,OFAIHLUXGCZDTK-SEDIIXAXSA-N,"InChI=1S/C33H44O11/c1-9-18(2)29(37)43-28-25(40-21(5)35)15-19(3)33-27(41-22(6)36)24(31(7,8)44-33)16-26(32(28,33)17-39-20(4)34)42-30(38)23-13-11-10-12-14-23/h10-14,18-19,24-28H,9,15-17H2,1-8H3/t18-,19-,24-,25+,26-,27-,28+,32-,33-/m1/s1",CC[C@@H](C)C(=O)O[C@H]1[C@@H](OC(C)=O)C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@@H](OC(=O)c4ccccc4)[C@]12COC(C)=O)[C@H]3OC(C)=O,C33H44O11,pos_1_minus1proton2sodium,616.288362228,OFAIHLUXGCZDTK,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,0,7.0 4530,4187,-1,,,,0.0,MS1_match,VPOHIHRBJNYFHU-ZBONBIFWSA-N,"InChI=1S/C50H82O18/c1-23-18-49(9)26(27-19-45(4,5)15-16-50(23,27)68-25(3)53)17-29(61-10)41-46(6)13-12-32(47(7,22-52)31(46)11-14-48(41,49)8)65-43-37(59)35(57)39(30(20-51)64-43)66-44-38(60)40(33(55)24(2)63-44)67-42-36(58)34(56)28(54)21-62-42/h17,23-24,27-44,51-52,54-60H,11-16,18-22H2,1-10H3/t23-,24-,27-,28+,29+,30+,31+,32-,33-,34-,35+,36+,37+,38+,39+,40+,41+,42-,43-,44-,46-,47-,48+,49+,50-/m0/s1",CO[C@@H]1C=C2[C@@H]3CC(C)(C)CC[C@]3(OC(C)=O)[C@@H](C)C[C@@]2(C)[C@]2(C)CC[C@H]3[C@](C)(CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@H](O)[C@H]4O)CC[C@]3(C)[C@@H]12,C50H82O18,pos_3_1proton2sodium,970.550115784,VPOHIHRBJNYFHU,Terpenoids,Triterpenoids,Oleanane triterpenoids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 4531,4185,69,Terpenoids,Sesquiterpenoids,Furans,0.62949234,ISDB,JAABKYCBTCTCDQ-BOVGMKJQSA-N,"InChI=1S/C19H30O2/c1-14(2)19(20)21-13-16(4)7-6-8-17(5)18-11-9-15(3)10-12-18/h7,9,11,14,17H,6,8,10,12-13H2,1-5H3/b16-7-/t17-/m1/s1",CC1=CC=C([C@H](C)CC/C=C(/C)COC(=O)C(C)C)CC1,C19H30O2,,290.2245802,JAABKYCBTCTCDQ,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Pulicaria gnaphalodes,3899094.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pulicaria'],['Pulicaria gnaphalodes'],4,2,7.517969369888306 4532,4183,205,Terpenoids,Octadecanoids,Abeoabietane diterpenoids,0.0,MS1_match,FPRGRROJPRIHJP-UHFFFAOYSA-N,"InChI=1S/C20H24O4/c1-9(2)11-7-13(21)19(5)17(15(11)23)20(6)14(22)8-12(10(3)4)16(24)18(19)20/h7-10,17-18H,1-6H3",CC(C)C1=CC(=O)C2(C)C(C1=O)C1(C)C(=O)C=C(C(C)C)C(=O)C21,C20H24O4,pos_2_2proton,328.167459248,FPRGRROJPRIHJP,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 4533,4177,1801,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,0.2725679,ISDB,IOUQUFVYKJOHBO-SYUMXFIHSA-N,"InChI=1S/C25H37NO3S/c1-16-8-6-9-21-24(16,3)11-10-17(2)25(21,4)15-18-22(28)19(14-20(27)23(18)29)26-12-7-13-30-5/h8,14,17,21,26,29H,6-7,9-13,15H2,1-5H3/t17-,21+,24-,25+/m0/s1",CSCCCNC1=CC(=O)C(O)=C(C[C@]2(C)[C@@H](C)CC[C@@]3(C)C(C)=CCC[C@@H]23)C1=O,C25H37NO3S,,431.2494150440001,IOUQUFVYKJOHBO,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Dactylospongia metachromia,533033.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Dictyoceratida'],['Thorectidae'],['Unknown'],['Dactylospongia'],['Dactylospongia metachromia'],1,3,3.5902715921401978 4534,4173,-1,,,,0.0,MS1_match,NDUIFQPPDDOKRN-UHFFFAOYSA-N,"InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8H,4-6H2,1-3H3",CC1=C2CC(CC1)C2(C)C,C10H16,pos_1_1proton,136.125200512,NDUIFQPPDDOKRN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4535,4173,-1,,,,0.0,MS1_match,VYBREYKSZAROCT-UHFFFAOYSA-N,"InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5H,1-2,4,6-8H2,3H3",C=CC(=C)CCCC(=C)C,C10H16,pos_1_1proton,136.125200512,VYBREYKSZAROCT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4536,4173,-1,,,,0.0,MS1_match,GRWFGVWFFZKLTI-UHFFFAOYSA-N,"InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3",CC1=CCC2CC1C2(C)C,C10H16,pos_1_1proton,136.125200512,GRWFGVWFFZKLTI,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4537,4170,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.0,MS1_match,JGMYDQCXGIMHLL-WAYWQWQTSA-N,"InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h5-6H,2-4,7-15H2,1H3,(H,17,18)/b6-5-",CCCC/C=C\CCCCCCCCCC(=O)O,C16H30O2,pos_1_1sodium1acetonitrile,254.2245802,JGMYDQCXGIMHLL,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 4538,4164,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.2173858,ISDB,JNFGTEZBSNFLIN-XHOKYKBNSA-N,"InChI=1S/C14H18O/c1-3-4-5-6-7-9-13-10-8-11-14(15)12(13)2/h5-9,11,13H,2-4,10H2,1H3/b6-5+,9-7+/t13-/m1/s1",C=C1C(=O)C=CC[C@H]1/C=C/C=C/CCC,C14H18O,,202.135765196,JNFGTEZBSNFLIN,Polyketides,,,Penicillium,199764.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Unknown'],1,0,1.869543194770813 4539,4162,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.5535115,ISDB,KXJAPGVKHIYNOZ-HCLJLRJYSA-N,"InChI=1S/C27H40O12/c1-6-27(4,34)9-7-8-13(2)23(32)36-12-18-20(29)21(30)22(31)26(38-18)39-25-19-14(3)17(28)10-15(19)16(11-37-25)24(33)35-5/h6,8,11,14-15,17-22,25-26,28-31,34H,1,7,9-10,12H2,2-5H3/b13-8+/t14-,15+,17-,18+,19+,20+,21-,22+,25-,26-,27?/m0/s1",C=CC(C)(O)CC/C=C(\C)C(=O)OC[C@H]1O[C@@H](O[C@@H]2OC=C(C(=O)OC)[C@H]3C[C@H](O)[C@H](C)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O,C27H40O12,,556.25197672,KXJAPGVKHIYNOZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Jasminum nervosum,1070447.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Jasmineae'],['Jasminum'],['Jasminum nervosum'],4,2,7.214046001434326 4540,4160,-1,,,,0.28015697,ISDB,HCUIHIKPUYHKSQ-UHFFFAOYSA-N,"InChI=1S/C36H70O4/c1-3-5-7-9-10-11-12-13-14-15-16-17-22-25-29-33-36(39)40-34(30-26-8-6-4-2)31-27-23-20-18-19-21-24-28-32-35(37)38/h34H,3-33H2,1-2H3,(H,37,38)",CCCCCCCCCCCCCCCCCC(=O)OC(CCCCCC)CCCCCCCCCCC(=O)O,C36H70O4,,566.52741072,HCUIHIKPUYHKSQ,Fatty acids,Fatty esters,Fatty acid estolides,Bos taurus,490099.0,['Eukaryota'],['Metazoa'],['Chordata'],['Mammalia'],['Artiodactyla'],['Bovidae'],['Unknown'],['Bos'],['Bos taurus'],1,0,2.1206278800964355 4541,4156,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.7784031,ISDB,FLXYFXDZJHWWGW-VJQRDGCPSA-N,"InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3/t11-,12-,13+,14-,15+,16-/m1/s1",C=C[C@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O6,,316.18858861599995,FLXYFXDZJHWWGW,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Jasminum sambac,295476.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Jasmineae'],['Jasminum'],['Jasminum sambac'],4,2,8.113612413406372 4542,4156,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.7784031,ISDB,FLXYFXDZJHWWGW-VJQRDGCPSA-N,"InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3/t11-,12-,13+,14-,15+,16-/m1/s1",C=C[C@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O6,,316.18858861599995,FLXYFXDZJHWWGW,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Cunila spicata,6082207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Cunila'],['Cunila spicata'],4,2,8.113612413406372 4543,4156,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.7784031,ISDB,FLXYFXDZJHWWGW-RDGWLKQMSA-N,"InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3/t11-,12-,13+,14-,15+,16+/m1/s1",C=C[C@@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O6,,316.18858861599995,FLXYFXDZJHWWGW,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Hypericum sikokumontanum,354155.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum sikokumontanum'],4,2,8.113612413406372 4544,4156,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.7784031,ISDB,FLXYFXDZJHWWGW-BKQXGZDCSA-N,"InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3/t11-,12-,13+,14-,15-,16-/m1/s1",C=C[C@](C)(CCC=C(C)C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O6,,316.188588616,FLXYFXDZJHWWGW,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Pluchea indica,446140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pluchea'],['Pluchea indica'],4,2,8.113612413406372 4545,4156,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.7784031,ISDB,FLXYFXDZJHWWGW-VJQRDGCPSA-N,"InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3/t11-,12-,13+,14-,15+,16-/m1/s1",C=C[C@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O6,,316.18858861599995,FLXYFXDZJHWWGW,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Perilla frutescens,295678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Elsholtzieae'],['Perilla'],['Perilla frutescens'],4,2,8.113612413406372 4546,4156,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.7784031,ISDB,FLXYFXDZJHWWGW-VTMBPIDISA-N,"InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3/t11-,12-,13+,14+,15+,16-/m1/s1",C=C[C@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C16H28O6,,316.18858861599995,FLXYFXDZJHWWGW,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Zingiber officinale,1063866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Zingiber'],['Zingiber officinale'],4,2,8.113612413406372 4547,4154,-1,,,,0.36035657,ISDB,,,,,,,FIZJZWZJPTWTSY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4414262771606445 4548,4153,-1,,,,0.28139624,ISDB,ZVPAWIUOYQZBHZ-HJWRWDBZSA-N,"InChI=1S/C19H35NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(21)20-17-19(22)23-2/h8-9H,3-7,10-17H2,1-2H3,(H,20,21)/b9-8-",CCCCCC/C=C\CCCCCCCC(=O)NCC(=O)OC,C19H35NO3,,325.26169398,ZVPAWIUOYQZBHZ,Fatty acids,Fatty amides,N-acyl amines,Loktanella,154832.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Alphaproteobacteria'],['Rhodobacterales'],['Rhodobacteraceae'],['Unknown'],['Loktanella'],['Unknown'],0,0,1.1255849599838257 4549,4151,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MHNH3,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,1,6.5 4550,4151,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MHNH3,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,1,6.5 4551,4151,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MHNH3,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 4552,4151,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_2MHNH3,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 4553,4149,-1,,,,0.0,MS1_match,IJVBJQZGTABEMP-CONSDPRKSA-N,"InChI=1S/C42H52N2O10/c1-43-15-13-25-20-34(47-4)35(22-28(25)30(43)17-24-11-12-33(46-3)32(45)18-24)54-37-21-26(38(49-6)42(53-10)41(37)52-9)19-31-29-23-36(48-5)40(51-8)39(50-7)27(29)14-16-44(31)2/h11-12,18,20-23,30-31,45H,13-17,19H2,1-10H3/t30-,31-/m0/s1",COc1ccc(C[C@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)c(OC)c6CCN5C)c(OC)c(OC)c4OC)c(OC)cc3CCN2C)cc1O,C42H52N2O10,pos_2_2proton2acetonitrile,744.362195864,IJVBJQZGTABEMP,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Isopyrum thalictroides,949657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Isopyrum'],['Isopyrum thalictroides'],6,0,6.0 4554,4146,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.39258587,ISDB,,,,,,,OELDKSOVLPNCTH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5703434944152832 4555,4145,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_1proton1acetonitrile,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 4556,4145,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_1proton1acetonitrile,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 4557,4142,-1,,,,0.4799906,ISDB,CRCGZPVGNSFIDX-KYJSFNMBSA-N,"InChI=1S/C18H24O3/c1-10-7-11-8-14(20)16-17(2,3)15(21)5-6-18(16,4)12(11)9-13(10)19/h7,9,14,16,19-20H,5-6,8H2,1-4H3/t14-,16-,18+/m1/s1",Cc1cc2c(cc1O)[C@]1(C)CCC(=O)C(C)(C)[C@H]1[C@H](O)C2,C18H24O3,,288.172544628,CRCGZPVGNSFIDX,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Flueggea virosa,351505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Flueggea'],['Flueggea virosa'],4,0,5.919962406158447 4558,4127,-1,,,,0.0,MS1_match,GYYLLXIKQCROMN-PBBATNOCSA-N,"InChI=1S/C42H70O14/c1-20(22-9-11-37(2,3)56-22)28-21(45)15-40(6)26-8-7-25-38(4,19-52-35-33(50)31(48)29(46)23(16-43)53-35)27(55-36-34(51)32(49)30(47)24(17-44)54-36)10-12-41(25)18-42(26,41)14-13-39(28,40)5/h20-36,43-51H,7-19H2,1-6H3/t20-,21+,22+,23-,24-,25+,26+,27+,28+,29+,30-,31+,32+,33-,34-,35-,36+,38+,39-,40+,41-,42+/m1/s1",C[C@@H]([C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4[C@](C)(CO[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C)[C@@H]1CCC(C)(C)O1,C42H70O14,pos_2_1proton1sodium,798.47655692,GYYLLXIKQCROMN,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 4559,4127,-1,,,,0.0,MS1_match,DWONHNNHWHSAHV-OWAXYDLBSA-N,"InChI=1S/C42H70O14/c1-20(2)7-8-22(45)21(3)29-23(46)15-40(6)27-10-9-26-38(4,19-53-36-34(51)32(49)30(47)24(16-43)54-36)28(56-37-35(52)33(50)31(48)25(17-44)55-37)11-12-41(26)18-42(27,41)14-13-39(29,40)5/h7,21-37,43-52H,8-19H2,1-6H3/t21-,22+,23+,24-,25-,26+,27-,28+,29+,30-,31+,32+,33+,34-,35-,36-,37+,38+,39-,40+,41-,42+/m1/s1",CC(C)=CC[C@H](O)[C@@H](C)[C@H]1[C@@H](O)C[C@@]2(C)[C@H]3CC[C@H]4[C@](C)(CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C,C42H70O14,pos_2_1proton1sodium,798.47655692,DWONHNNHWHSAHV,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 4560,4125,-1,,,,0.52844065,ISDB,,,,,,,ZCSPMSRILJREOV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.113762617111206 4561,4123,614,Fatty acids,Glycerophospholipids,Glycerophosphates,0.7971584,ISDB,DVNZKWQUAXJYGB-UHFFFAOYSA-N,"InChI=1S/C21H37O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h3-4,6-7,9-10,20,22H,2,5,8,11-19H2,1H3,(H2,24,25,26)",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)(O)O,C21H37O7P,,432.2276901539999,DVNZKWQUAXJYGB,Fatty acids,Glycerophospholipids,Glycerophosphates,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.688633680343628 4562,4122,-1,,,,0.7136223,ISDB,VJELPTFOTXKQJX-NYXMCYOFSA-N,"InChI=1S/C32H40O10/c1-7-8-9-10-11-12-13-14-29-40-26-22-25-28(16-33,39-25)27(36)30(37)21(15-18(4)23(30)35)32(22,42-29)19(5)24(38-20(6)34)31(26,41-29)17(2)3/h9-15,19,21-22,24-27,33,36-37H,2,7-8,16H2,1,3-6H3/t19-,21-,22+,24-,25+,26-,27-,28+,29-,30-,31-,32+/m1/s1",C=C(C)[C@]12O[C@@]3(C=CC=CC=CCCC)O[C@@H]1[C@@H]1[C@@H]4O[C@]4(CO)[C@@H](O)[C@]4(O)C(=O)C(C)=C[C@H]4[C@@]1(O3)[C@H](C)[C@H]2OC(C)=O,C32H40O10,,584.26214748,VJELPTFOTXKQJX,Terpenoids,Diterpenoids,Daphnane diterpenoids,Synaptolepis kirkii,6119675.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Synaptolepis'],['Synaptolepis kirkii'],4,0,6.854489088058472 4563,4122,-1,,,,0.7136223,ISDB,VJELPTFOTXKQJX-GFMSAKSFSA-N,"InChI=1S/C32H40O10/c1-7-8-9-10-11-12-13-14-29-40-26-22-25-28(16-33,39-25)27(36)30(37)21(15-18(4)23(30)35)32(22,42-29)19(5)24(38-20(6)34)31(26,41-29)17(2)3/h9-15,19,21-22,24-27,33,36-37H,2,7-8,16H2,1,3-6H3/b10-9-,12-11+,14-13+/t19-,21-,22+,24-,25+,26-,27-,28+,29?,30-,31+,32+/m1/s1",C=C(C)[C@@]12OC3(/C=C/C=C/C=C\CCC)O[C@@H]1[C@@H]1[C@@H]4O[C@]4(CO)[C@@H](O)[C@]4(O)C(=O)C(C)=C[C@H]4[C@@]1(O3)[C@H](C)[C@H]2OC(C)=O,C32H40O10,,584.2621474799998,VJELPTFOTXKQJX,Terpenoids,Diterpenoids,Daphnane diterpenoids,Daphne genkwa,5516227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Daphne'],['Daphne genkwa'],4,0,6.854489088058472 4564,4122,-1,,,,0.7136223,ISDB,VJELPTFOTXKQJX-GFMSAKSFSA-N,"InChI=1S/C32H40O10/c1-7-8-9-10-11-12-13-14-29-40-26-22-25-28(16-33,39-25)27(36)30(37)21(15-18(4)23(30)35)32(22,42-29)19(5)24(38-20(6)34)31(26,41-29)17(2)3/h9-15,19,21-22,24-27,33,36-37H,2,7-8,16H2,1,3-6H3/b10-9-,12-11+,14-13+/t19-,21-,22+,24-,25+,26-,27-,28+,29?,30-,31+,32+/m1/s1",C=C(C)[C@@]12OC3(/C=C/C=C/C=C\CCC)O[C@@H]1[C@@H]1[C@@H]4O[C@]4(CO)[C@@H](O)[C@]4(O)C(=O)C(C)=C[C@H]4[C@@]1(O3)[C@H](C)[C@H]2OC(C)=O,C32H40O10,,584.2621474799998,VJELPTFOTXKQJX,Terpenoids,Diterpenoids,Daphnane diterpenoids,Pimelea elongata,6119607.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Pimelea'],['Pimelea elongata'],4,0,6.854489088058472 4565,4122,-1,,,,0.7136223,ISDB,VJELPTFOTXKQJX-NYXMCYOFSA-N,"InChI=1S/C32H40O10/c1-7-8-9-10-11-12-13-14-29-40-26-22-25-28(16-33,39-25)27(36)30(37)21(15-18(4)23(30)35)32(22,42-29)19(5)24(38-20(6)34)31(26,41-29)17(2)3/h9-15,19,21-22,24-27,33,36-37H,2,7-8,16H2,1,3-6H3/t19-,21-,22+,24-,25+,26-,27-,28+,29-,30-,31-,32+/m1/s1",C=C(C)[C@]12O[C@@]3(C=CC=CC=CCCC)O[C@@H]1[C@@H]1[C@@H]4O[C@]4(CO)[C@@H](O)[C@]4(O)C(=O)C(C)=C[C@H]4[C@@]1(O3)[C@H](C)[C@H]2OC(C)=O,C32H40O10,,584.26214748,VJELPTFOTXKQJX,Terpenoids,Diterpenoids,Daphnane diterpenoids,Synaptolepis retusa,6119678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Synaptolepis'],['Synaptolepis retusa'],4,0,6.854489088058472 4566,4122,-1,,,,0.7136223,ISDB,VJELPTFOTXKQJX-ROTRNVGISA-N,"InChI=1S/C32H40O10/c1-7-8-9-10-11-12-13-14-29-40-26-22-25-28(16-33,39-25)27(36)30(37)21(15-18(4)23(30)35)32(22,42-29)19(5)24(38-20(6)34)31(26,41-29)17(2)3/h9-15,19,21-22,24-27,33,36-37H,2,7-8,16H2,1,3-6H3/b10-9+,12-11+,14-13+/t19-,21-,22+,24-,25+,26-,27-,28+,29-,30-,31+,32+/m1/s1",C=C(C)[C@@]12O[C@@]3(/C=C/C=C/C=C/CCC)O[C@@H]1[C@@H]1[C@@H]4O[C@]4(CO)[C@@H](O)[C@]4(O)C(=O)C(C)=C[C@H]4[C@@]1(O3)[C@H](C)[C@H]2OC(C)=O,C32H40O10,,584.26214748,VJELPTFOTXKQJX,Terpenoids,Diterpenoids,Daphnane diterpenoids,Daphne acutiloba,6119220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Daphne'],['Daphne acutiloba'],4,0,6.854489088058472 4567,4121,418,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,ULNMNTRLMCFPLP-FLATUHHWSA-N,"InChI=1S/C20H25NO/c1-10-5-19-8-14-16-18(2)6-12(22)7-20(16)15(19)4-11(10)3-13(19)17(20)21(14)9-18/h11,13-17H,1,3-9H2,2H3/t11-,13+,14-,15+,16+,17+,18-,19-,20+/m0/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@@]6(C)CC(=O)C[C@@]57[C@@H]2C[C@@H]1C[C@@H]3[C@H]7N4C6,C20H25NO,pos_1_1proton,295.19361442,ULNMNTRLMCFPLP,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tanguticum,1088652.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tanguticum'],6,1,6.5 4568,4115,11,Terpenoids,Diterpenoids,Monocyclic monoterpenoids,0.7126825,ISDB,JMDWDRGHOPRHGO-NMCQGECBSA-N,"InChI=1S/C16H28O7/c1-8(2)16(5-4-9(3)6-11(16)18)23-15-14(21)13(20)12(19)10(7-17)22-15/h6,8,10-15,17-21H,4-5,7H2,1-3H3/t10-,11+,12-,13+,14+,15+,16-/m1/s1",CC1=C[C@H](O)[C@](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)(C(C)C)CC1,C16H28O7,,332.183503236,JMDWDRGHOPRHGO,Terpenoids,Monoterpenoids,Monocyclic monoterpenoids,Origanum syriacum,731839.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Origanum'],['Origanum syriacum'],4,3,8.350729942321777 4569,4113,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6877613,ISDB,JAKAZHIACKJNNB-RTBURBONSA-N,"InChI=1S/C19H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h1,18-19,21-22H,4-16H2,2H3/t18-,19-/m1/s1",C#CCCCCCCCCCCC[C@@H](O)C[C@@H](O)COC(C)=O,C19H34O4,,326.24570956799994,JAKAZHIACKJNNB,Fatty acids,Fatty acyls,Fatty alcohols,Persea americana,913249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Persea'],['Persea americana'],4,1,7.251045227050781 4570,4103,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,DDBFXHRHQKHBNN-UHFFFAOYSA-N,"InChI=1S/C25H44O8/c1-6-22(2,31)10-7-17-23(3)11-9-18(28)24(4,14-26)16(23)8-12-25(17,5)33-21-20(30)19(29)15(27)13-32-21/h6,15-21,26-31H,1,7-14H2,2-5H3",C=CC(C)(O)CCC1C(C)(OC2OCC(O)C(O)C2O)CCC2C(C)(CO)C(O)CCC12C,C25H44O8,pos_2MK,472.303618368,DDBFXHRHQKHBNN,Terpenoids,Diterpenoids,Labdane diterpenoids,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,0,6.0 4571,4103,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,DDBFXHRHQKHBNN-JLBBAOFQSA-N,"InChI=1S/C25H44O8/c1-6-22(2,31)10-7-17-23(3)11-9-18(28)24(4,14-26)16(23)8-12-25(17,5)33-21-20(30)19(29)15(27)13-32-21/h6,15-21,26-31H,1,7-14H2,2-5H3/t15-,16+,17+,18-,19-,20+,21-,22+,23-,24-,25+/m0/s1",C=C[C@@](C)(O)CC[C@@H]1[C@@]2(C)CC[C@H](O)[C@@](C)(CO)[C@@H]2CC[C@@]1(C)O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O,C25H44O8,pos_2MK,472.30361836799983,DDBFXHRHQKHBNN,Terpenoids,Diterpenoids,Labdane diterpenoids,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,0,6.0 4572,4103,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,DDBFXHRHQKHBNN-UHFFFAOYSA-N,"InChI=1S/C25H44O8/c1-6-22(2,31)10-7-17-23(3)11-9-18(28)24(4,14-26)16(23)8-12-25(17,5)33-21-20(30)19(29)15(27)13-32-21/h6,15-21,26-31H,1,7-14H2,2-5H3",C=CC(C)(O)CCC1C(C)(OC2OCC(O)C(O)C2O)CCC2C(C)(CO)C(O)CCC12C,C25H44O8,pos_2MK,472.303618368,DDBFXHRHQKHBNN,Terpenoids,Diterpenoids,Labdane diterpenoids,Aquilegia viridiflora,203768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia viridiflora'],6,0,6.0 4573,4103,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,DDBFXHRHQKHBNN-JLBBAOFQSA-N,"InChI=1S/C25H44O8/c1-6-22(2,31)10-7-17-23(3)11-9-18(28)24(4,14-26)16(23)8-12-25(17,5)33-21-20(30)19(29)15(27)13-32-21/h6,15-21,26-31H,1,7-14H2,2-5H3/t15-,16+,17+,18-,19-,20+,21-,22+,23-,24-,25+/m0/s1",C=C[C@@](C)(O)CC[C@@H]1[C@@]2(C)CC[C@H](O)[C@@](C)(CO)[C@@H]2CC[C@@]1(C)O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O,C25H44O8,pos_2MK,472.30361836799983,DDBFXHRHQKHBNN,Terpenoids,Diterpenoids,Labdane diterpenoids,Aquilegia cultorum,3945151.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Aquilegia'],['Aquilegia cultorum'],6,0,6.0 4574,4099,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.9049333,ISDB,PMQFRYOUROAMMQ-SKIKXBICSA-N,"InChI=1S/C30H26O14/c31-15-5-3-14(4-6-15)19-10-18(34)24-20(42-19)11-21(25(36)27(24)38)43-30-29(40)28(39)26(37)22(44-30)12-41-23(35)8-2-13-1-7-16(32)17(33)9-13/h1-11,22,26,28-33,36-40H,12H2/b8-2+/t22-,26-,28+,29-,30-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O14,,610.132255512,PMQFRYOUROAMMQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Halophila ovalis,861013.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Hydrocharitaceae'],['Unknown'],['Halophila'],['Halophila ovalis'],4,3,9.119733095169067 4575,4099,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.9049333,ISDB,PMQFRYOUROAMMQ-SKIKXBICSA-N,"InChI=1S/C30H26O14/c31-15-5-3-14(4-6-15)19-10-18(34)24-20(42-19)11-21(25(36)27(24)38)43-30-29(40)28(39)26(37)22(44-30)12-41-23(35)8-2-13-1-7-16(32)17(33)9-13/h1-11,22,26,28-33,36-40H,12H2/b8-2+/t22-,26-,28+,29-,30-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O14,,610.132255512,PMQFRYOUROAMMQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Halophila johnsonii,538431.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Hydrocharitaceae'],['Unknown'],['Halophila'],['Halophila johnsonii'],4,3,9.119733095169067 4576,4098,-1,,,,0.35925072,ISDB,TXHIPUZLOILIIU-UHFFFAOYSA-N,"InChI=1S/C18H29NO5/c1-3-12(2)17(18(23)24)19-16(22)11-13-8-9-15(21)14(13)7-5-4-6-10-20/h4-5,12-14,17,20H,3,6-11H2,1-2H3,(H,19,22)(H,23,24)",CCC(C)C(NC(=O)CC1CCC(=O)C1CC=CCCO)C(=O)O,C18H29NO5,,339.204573028,TXHIPUZLOILIIU,,,,Vicia faba,539544.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Vicia'],['Vicia faba'],4,0,5.437002897262573 4577,4090,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,DDSRZDYFCBJOAE-UHFFFAOYSA-N,"InChI=1S/C20H33NO5/c1-3-21-8-18(2)13-6-10-14-11(4-5-19(26,9-22)17(14)25)20(13,15(10)21)7-12(23)16(18)24/h10-17,22-26H,3-9H2,1-2H3",CCN1CC2(C)C(O)C(O)CC34C5CCC(O)(CO)C(O)C5C(CC23)C14,C20H33NO5,pos_1_1proton1methanol,367.235873156,DDSRZDYFCBJOAE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 4578,4088,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YQUVCSBJEUQKSH-UHFFFAOYSA-N,"InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)",O=C(O)c1ccc(O)c(O)c1,C7H6O4,pos_2MH,154.026608672,YQUVCSBJEUQKSH,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,1,8.5 4579,4086,57,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.0,MS1_match,AYNPTULQRUYIBL-KDSRJQFPSA-N,"InChI=1S/C39H64O9/c1-9-10-17-45-34(5,6)30-23-18-21(2)29-35(7)15-16-38-20-37(38)14-13-26(46-31-28(42)27(41)22(40)19-44-31)33(3,4)24(37)11-12-25(38)36(35,8)32(43)39(29,47-23)48-30/h21-32,40-43H,9-20H2,1-8H3/t21-,22-,23-,24+,25+,26+,27+,28-,29-,30+,31+,32-,35-,36-,37-,38+,39+/m1/s1",CCCCOC(C)(C)[C@H]1O[C@@]23O[C@@H]1C[C@@H](C)[C@@H]2[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@H]3O,C39H64O9,pos_1_1proton,676.455033628,AYNPTULQRUYIBL,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea yunnanensis,512689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea yunnanensis'],6,3,7.5 4580,4085,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.2854991,ISDB,UTUISHMYVAZILQ-UHFFFAOYSA-N,"InChI=1S/C30H26O12/c31-14-24-29(42-25(36)10-3-15-1-6-17(32)7-2-15)27(37)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2",O=C(C=Cc1ccc(O)cc1)OC1C(CO)OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)C(O)C1O,C30H26O12,,578.142426272,UTUISHMYVAZILQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],9,3,11.641996383666992 4581,4084,-1,,,,0.0,MS1_match,WHWDWIHXSPCOKZ-UHFFFAOYSA-N,"InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3",CC(=O)CCCC(C)CCCC(C)CCCC(C)C,C18H36O,pos_1_1proton2acetonitrile,268.276615772,WHWDWIHXSPCOKZ,Terpenoids,Diterpenoids,Phytane diterpenoids,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,0,6.0 4582,4078,-1,,,,0.0,MS1_match,ISDXMFLGMQJRBT-UHFFFAOYSA-N,"InChI=1S/C40H44N2O7/c1-26(2)31-16-17-40(25-46-35(43)21-28-10-6-5-7-11-28)34(48-38(45)30-13-9-19-42-24-30)20-27(3)14-15-33-39(4,49-33)22-32(36(31)40)47-37(44)29-12-8-18-41-23-29/h5-13,18-20,23-24,32-34,36H,14-17,21-22,25H2,1-4H3",CC1=CC(OC(=O)c2cccnc2)C2(COC(=O)Cc3ccccc3)CCC(=C(C)C)C2C(OC(=O)c2cccnc2)CC2(C)OC2CC1,C40H44N2O7,pos_1_sodium,664.314851748,ISDXMFLGMQJRBT,Terpenoids,Diterpenoids,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 4583,4078,-1,,,,0.0,MS1_match,BSEREUYHFDTZAR-CYVCHDHYSA-N,"InChI=1S/C40H44N2O7/c1-26(2)31-17-18-40(25-46-35(43)28-11-7-6-8-12-28)33(47-36(44)29-13-9-19-41-23-29)21-27(3)15-16-32-38(4,49-32)22-34(39(31,40)5)48-37(45)30-14-10-20-42-24-30/h6-14,19-21,23-24,32-34H,15-18,22,25H2,1-5H3/b27-21+/t32-,33-,34+,38-,39+,40-/m0/s1",CC(C)=C1CC[C@]2(COC(=O)c3ccccc3)[C@@H](OC(=O)c3cccnc3)/C=C(\C)CC[C@@H]3O[C@@]3(C)C[C@@H](OC(=O)c3cccnc3)[C@@]12C,C40H44N2O7,pos_1_sodium,664.314851748,BSEREUYHFDTZAR,Terpenoids,Diterpenoids,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 4584,4078,-1,,,,0.0,MS1_match,BSEREUYHFDTZAR-CYVCHDHYSA-N,"InChI=1S/C40H44N2O7/c1-26(2)31-17-18-40(25-46-35(43)28-11-7-6-8-12-28)33(47-36(44)29-13-9-19-41-23-29)21-27(3)15-16-32-38(4,49-32)22-34(39(31,40)5)48-37(45)30-14-10-20-42-24-30/h6-14,19-21,23-24,32-34H,15-18,22,25H2,1-5H3/b27-21+/t32-,33-,34+,38-,39+,40-/m0/s1",CC(C)=C1CC[C@]2(COC(=O)c3ccccc3)[C@@H](OC(=O)c3cccnc3)/C=C(\C)CC[C@@H]3O[C@@]3(C)C[C@@H](OC(=O)c3cccnc3)[C@@]12C,C40H44N2O7,pos_1_sodium,664.314851748,BSEREUYHFDTZAR,Terpenoids,Diterpenoids,,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,0,6.0 4585,4077,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1acetonitrile,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4586,4077,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1acetonitrile,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4587,4077,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1acetonitrile,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4588,4077,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1acetonitrile,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4589,4077,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1acetonitrile,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4590,4077,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1acetonitrile,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4591,4077,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1acetonitrile,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4592,4077,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1acetonitrile,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 4593,4077,-1,,,,0.0,MS1_match,NEVMWOQJRSZYIC-UUANRDTJSA-N,"InChI=1S/C30H36O18/c1-39-13-5-11-6-14(40-2)25(13)47-29-23(35)21(33)19(31)17(45-29)10-44-28(38)12-7-15(41-3)26(16(8-12)42-4)48-30-24(36)22(34)20(32)18(46-30)9-43-27(11)37/h5-8,17-24,29-36H,9-10H2,1-4H3/t17-,18-,19-,20-,21+,22+,23-,24-,29+,30+/m1/s1",COc1cc2cc(OC)c1O[C@@H]1O[C@H](COC(=O)c3cc(OC)c(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C30H36O18,pos_2_2proton2acetonitrile,684.190164312,NEVMWOQJRSZYIC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 4594,4076,467,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.30522585,ISDB,ZGFASEKBKWVCGP-UHFFFAOYSA-N,"InChI=1S/C20H18O4/c1-20(22-2)12-15(13-8-4-3-5-9-13)17-18(24-20)14-10-6-7-11-16(14)23-19(17)21/h3-11,15H,12H2,1-2H3",COC1(C)CC(c2ccccc2)c2c(c3ccccc3oc2=O)O1,C20H18O4,,322.12050905599995,ZGFASEKBKWVCGP,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Glycyrrhiza uralensis,284051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza uralensis'],4,3,6.720903396606445 4595,4076,467,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.30522585,ISDB,ZGFASEKBKWVCGP-UHFFFAOYSA-N,"InChI=1S/C20H18O4/c1-20(22-2)12-15(13-8-4-3-5-9-13)17-18(24-20)14-10-6-7-11-16(14)23-19(17)21/h3-11,15H,12H2,1-2H3",COC1(C)CC(c2ccccc2)c2c(c3ccccc3oc2=O)O1,C20H18O4,,322.12050905599995,ZGFASEKBKWVCGP,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Cullen corylifolium,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.720903396606445 4596,4076,467,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.30522585,ISDB,ZGFASEKBKWVCGP-UHFFFAOYSA-N,"InChI=1S/C20H18O4/c1-20(22-2)12-15(13-8-4-3-5-9-13)17-18(24-20)14-10-6-7-11-16(14)23-19(17)21/h3-11,15H,12H2,1-2H3",COC1(C)CC(c2ccccc2)c2c(c3ccccc3oc2=O)O1,C20H18O4,,322.12050905599995,ZGFASEKBKWVCGP,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Cullen corylifolia,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.720903396606445 4597,4075,-1,,,,0.7984772,ISDB,RRYTXWAMRRHHAA-UMBUOUCESA-N,"InChI=1S/C20H30O2/c1-16(2)14-5-7-18-9-8-17(3,12-18)6-4-15(18)19(14)10-11-20(16,21)22-13-19/h8-9,14-15,21H,4-7,10-13H2,1-3H3/t14-,15-,17-,18+,19+,20-/m0/s1",CC1(C)[C@@H]2CC[C@]34C=C[C@](C)(CC[C@@H]3[C@@]23CC[C@]1(O)OC3)C4,C20H30O2,,302.2245802,RRYTXWAMRRHHAA,Terpenoids,Diterpenoids,Beyerane diterpenoids,Excoecaria agallocha,475587.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Hippomaneae'],['Excoecaria'],['Excoecaria agallocha'],4,0,7.19390869140625 4598,4074,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.52334476,ISDB,BYDQKMZEOZVIJM-ZGCJARKRSA-N,"InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,8-9H,7,10H2,1-4H3/b6-5-,12-9-",C/C=C\C=C1\C(C)=CCCC1(C)C,C13H20,,176.15650064,BYDQKMZEOZVIJM,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Passiflora edulis,183517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora edulis'],4,1,6.593379020690918 4599,4073,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.696147,ISDB,RMTOFKWPCZJSGD-HNNXBMFYSA-N,"InChI=1S/C15H31NO/c1-4-6-8-9-11-13-15(16-14(3)17)12-10-7-5-2/h15H,4-13H2,1-3H3,(H,16,17)/t15-/m0/s1",CCCCCCC[C@H](CCCCC)NC(C)=O,C15H31NO,,241.240564612,RMTOFKWPCZJSGD,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Microcoleus lyngbyaceus,5616204.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Microcoleus'],['Microcoleus lyngbyaceus'],0,0,2.784588098526001 4600,4072,-1,,,,0.0,MS1_match,RTWCTRFVACGXAD-FUEGPVBASA-N,"InChI=1S/C32H44O14/c1-16(10-11-41-22-13-20-19(12-21(22)40-4)8-9-24(33)45-20)6-5-7-17(2)14-42-32-30(39)28(37)26(35)23(46-32)15-43-31-29(38)27(36)25(34)18(3)44-31/h7-10,12-13,18,23,25-32,34-39H,5-6,11,14-15H2,1-4H3/b16-10+,17-7-/t18-,23+,25-,26+,27+,28-,29+,30+,31+,32+/m0/s1",COc1cc2ccc(=O)oc2cc1OC/C=C(\C)CC/C=C(/C)CO[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C32H44O14,pos_1_sodium,652.273106088,RTWCTRFVACGXAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Coptis trifolia,982768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis trifolia'],6,0,6.0 4601,4070,11,Terpenoids,Diterpenoids,Monocyclic monoterpenoids,0.22926466,ISDB,JPYHCVFOUSSVQY-HEHNFIMWSA-N,"InChI=1S/C27H33NO4/c1-20(2)10-15-26(32-22(4)29)21(3)17-19-31-25-13-11-23(12-14-25)16-18-28-27(30)24-8-6-5-7-9-24/h5-14,17,26H,15-16,18-19H2,1-4H3,(H,28,30)/b21-17+",CC(=O)OC(CC=C(C)C)/C(C)=C/COc1ccc(CCNC(=O)c2ccccc2)cc1,C27H33NO4,,435.240958536,JPYHCVFOUSSVQY,,,,Swinglea glutinosa,232711.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Swinglea'],['Swinglea glutinosa'],4,0,4.917058646678925 4602,4069,391,Alkaloids,Ornithine alkaloids,Polyamines,0.53016245,ISDB,XBOFXNQZWQRVGD-UHFFFAOYSA-N,"InChI=1S/C22H40N2O/c1-24(25-2)20-15-13-11-9-7-5-3-4-6-8-10-12-14-17-22-18-16-19-23-21-22/h16,18-19,21H,3-15,17,20H2,1-2H3",CON(C)CCCCCCCCCCCCCCCc1cccnc1,C22H40N2O,,348.31406389999995,XBOFXNQZWQRVGD,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Calyx podatypa,298919.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Haplosclerida'],['Phloeodictyidae'],['Unknown'],['Calyx'],['Calyx podatypa'],1,1,3.620649814605713 4603,4068,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BKATZVAUANSCKN-QWRGUYRKSA-N,"InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1",CC(=O)OCC1=CC[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_1_1proton1methanol,194.130679816,BKATZVAUANSCKN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 4604,4068,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PBWRFXQNNGSAQG-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3",C=C1C(OC(C)=O)CC2(C(C)C)CC12,C12H18O2,pos_1_1proton1methanol,194.130679816,PBWRFXQNNGSAQG,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 4605,4068,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RWENJYLCELUBAE-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-8(2)10-6-11(13-4)9(3)12(7-10)14-5/h6-8H,1-5H3",COc1cc(C(C)C)cc(OC)c1C,C12H18O2,pos_1_1proton1methanol,194.130679816,RWENJYLCELUBAE,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 4606,4068,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,GVZSSHYAFJPRJY-GARJFASQSA-N,"InChI=1S/C12H18O2/c1-7-10-5-9(12(7,3)4)6-11(10)14-8(2)13/h9-11H,1,5-6H2,2-4H3/t9-,10-,11+/m0/s1",C=C1[C@@H]2C[C@@H](C[C@H]2OC(C)=O)C1(C)C,C12H18O2,pos_1_1proton1methanol,194.130679816,GVZSSHYAFJPRJY,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 4607,4068,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,OZBFUQLOVFXDNK-VWYCJHECSA-N,"InChI=1S/C12H18O2/c1-7-5-11(14-8(2)13)10-6-9(7)12(10,3)4/h5,9-11H,6H2,1-4H3/t9-,10+,11+/m1/s1",CC(=O)O[C@H]1C=C(C)[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_1_1proton1methanol,194.130679816,OZBFUQLOVFXDNK,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 4608,4062,-1,,,,0.0,MS1_match,HSUIVCLOAAJSRE-UHFFFAOYSA-N,"InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3",COCCOC(=O)c1ccccc1C(=O)OCCOC,C14H18O6,pos_2MHNH3,282.110338296,HSUIVCLOAAJSRE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4609,4062,-1,,,,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1acetonitrile,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 4610,4062,-1,,,,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1acetonitrile,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 4611,4062,-1,,,,0.0,MS1_match,VHHJRIJKJTYYIZ-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-10-14(4-3-9-27)5-7-16(18)36-20(12-28)22(30)15-6-8-17(19(11-15)35-2)37-26-25(33)24(32)23(31)21(13-29)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C26H36O12,pos_1_1proton1acetonitrile,540.220676592,VHHJRIJKJTYYIZ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 4612,4062,-1,,,,0.0,MS1_match,HZYWTYSKPVTFNA-URGBZLTBSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)30)25(38-26-24(33)23(32)22(31)20(12-28)37-26)21(13-29)36-17-8-5-14(4-3-9-27)10-19(17)35-2/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21+,22-,23+,24-,25+,26+/m1/s1",COc1cc([C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O,C26H36O12,pos_1_1proton1acetonitrile,540.220676592,HZYWTYSKPVTFNA,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 4613,4060,-1,,,,0.0,MS1_match,FPYKDTSNMCSLIB-ZHDNQQBJSA-O,"InChI=1S/C25H31NO12/c1-3-15-16(5-4-13-8-14(22(32)33)10-26(9-13)6-7-27)17(23(34)35-2)12-36-24(15)38-25-21(31)20(30)19(29)18(11-28)37-25/h3-5,8-10,12,15-16,18-21,24-25,27-31H,1,6-7,11H2,2H3/p+1/b5-4+/t15-,16+,18-,19-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)O)c[n+](CCO)c1,C25H32NO12+,pos_1_1potassium,538.19190188409,FPYKDTSNMCSLIB,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 4614,4049,-1,,,,0.0,MS1_match,ZKGBUDJODLZAHS-IOWSJCHKSA-N,"InChI=1S/C37H42N2O6/c1-38-14-12-25-19-35(43-4)32(40)21-28(25)30(38)16-23-6-9-27(10-7-23)45-37-18-24(8-11-34(37)42-3)17-31-29-22-33(41)36(44-5)20-26(29)13-15-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31+/m0/s1",COc1cc2c(cc1O)[C@@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(O)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C37H42N2O6,pos_1_minus1proton2sodium,610.304287064,ZKGBUDJODLZAHS,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 4615,4049,-1,,,,0.0,MS1_match,RNPHQDBXJJRLDE-UHFFFAOYSA-N,"InChI=1S/C37H42N2O6/c1-39-15-13-26-20-35(43-4)36(44-5)22-29(26)31(39)17-24-8-11-33(41-2)37(18-24)45-27-9-6-23(7-10-27)16-30-28-21-32(40)34(42-3)19-25(28)12-14-38-30/h6-11,18-22,30-31,38,40H,12-17H2,1-5H3",COc1cc2c(cc1O)C(Cc1ccc(Oc3cc(CC4c5cc(OC)c(OC)cc5CCN4C)ccc3OC)cc1)NCC2,C37H42N2O6,pos_1_minus1proton2sodium,610.304287064,RNPHQDBXJJRLDE,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum,190621.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Unknown'],6,0,6.0 4616,4047,-1,,,,0.31171015,ISDB,KYUNATJAFQPBJE-BXUZGUMPSA-N,"InChI=1S/C14H14O6/c1-14(11-2-3-12(18)19-11)6-9(17)13-8(16)4-7(15)5-10(13)20-14/h4-5,11,15-16H,2-3,6H2,1H3/t11-,14-/m1/s1",C[C@]1([C@H]2CCC(=O)O2)CC(=O)c2c(O)cc(O)cc2O1,C14H14O6,,278.079038168,KYUNATJAFQPBJE,Polyketides,Chromanes,Chromones,Microdiplodia,751960.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Botryosphaeriales'],['Botryosphaeriaceae'],['Unknown'],['Microdiplodia'],['Unknown'],1,0,2.2468405961990356 4617,4045,-1,,,,0.3527004,ISDB,FQFANWKSMOTSKK-UHFFFAOYSA-N,"InChI=1S/C16H26O4/c1-2-3-4-5-6-7-8-9-10-14-11-13(12-15(17)18)16(19)20-14/h2,13-14H,1,3-12H2,(H,17,18)",C=CCCCCCCCCC1CC(CC(=O)O)C(=O)O1,C16H26O4,,282.183109312,FQFANWKSMOTSKK,,,,Sextonia rubra,424385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Sextonia'],['Sextonia rubra'],4,0,5.410801649093628 4618,4042,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.0,MS1_match,YYXXGJKFOHXSML-QEJZJMRPSA-N,"InChI=1S/C15H20O2/c1-13(2)12-8-7-11(16)10-6-5-9-14(3,17-13)15(10,12)4/h6-8,12H,5,9H2,1-4H3/t12-,14-,15-/m0/s1",CC1(C)O[C@@]2(C)CCC=C3C(=O)C=C[C@@H]1[C@]32C,C15H20O2,pos_2MH,232.14632988,YYXXGJKFOHXSML,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 4619,4039,-1,,,,0.0,MS1_match,KCDXJAYRVLXPFO-UHFFFAOYSA-N,"InChI=1S/C9H10O4/c1-12-7-3-6(5-10)4-8(13-2)9(7)11/h3-5,11H,1-2H3",COc1cc(C=O)cc(OC)c1O,C9H10O4,pos_1_1proton,182.0579088,KCDXJAYRVLXPFO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,0,6.0 4620,4039,-1,,,,0.0,MS1_match,KCDXJAYRVLXPFO-UHFFFAOYSA-N,"InChI=1S/C9H10O4/c1-12-7-3-6(5-10)4-8(13-2)9(7)11/h3-5,11H,1-2H3",COc1cc(C=O)cc(OC)c1O,C9H10O4,pos_1_1proton,182.0579088,KCDXJAYRVLXPFO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Gymnosporia pyria,35847.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia pyria'],6,0,6.0 4621,4038,152,Fatty acids,Fatty Acids and Conjugates,Eremophilane sesquiterpenoids,0.0,MS1_match,AOCLIMDHBMBYGD-NQWMYEDTSA-N,"InChI=1S/C16H28O2/c1-10-8-12(17)13-15(10,4)9-11-6-7-16(13,5)18-14(11,2)3/h10-13,17H,6-9H2,1-5H3/t10-,11-,12-,13-,15-,16+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@]1(C)C[C@H]1CC[C@]2(C)OC1(C)C,C16H28O2,pos_1_1proton1methanol,252.208930136,AOCLIMDHBMBYGD,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 4622,4033,-1,,,,0.0,MS1_match,DRSUFQXLYTXQGX-GKRDPSGZSA-N,"InChI=1S/C35H40O11/c1-20-17-27(42-21(2)36)30(44-23(4)38)34(19-41-31(39)24-13-9-7-10-14-24)28(45-32(40)25-15-11-8-12-16-25)18-26-29(43-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26+,27+,28+,29+,30+,34+,35+/m0/s1",CC(=O)O[C@@H]1[C@H](OC(C)=O)C[C@H](C)[C@]23OC(C)(C)[C@H](C[C@@H](OC(=O)c4ccccc4)[C@]12COC(=O)c1ccccc1)[C@H]3OC(C)=O,C35H40O11,pos_1_sodium,636.2570621,DRSUFQXLYTXQGX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Microtropis fokienensis,1015845.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis fokienensis'],6,0,6.0 4623,4033,-1,,,,0.0,MS1_match,DRSUFQXLYTXQGX-HDWLWNEUSA-N,"InChI=1S/C35H40O11/c1-20-17-27(42-21(2)36)30(44-23(4)38)34(19-41-31(39)24-13-9-7-10-14-24)28(45-32(40)25-15-11-8-12-16-25)18-26-29(43-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26-,27+,28+,29-,30+,34-,35-/m1/s1",CC(=O)O[C@H]1C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(COC(=O)c2ccccc2)[C@H]1OC(C)=O)[C@H]3OC(C)=O,C35H40O11,pos_1_sodium,636.2570620999999,DRSUFQXLYTXQGX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,0,6.0 4624,4033,-1,,,,0.0,MS1_match,DRSUFQXLYTXQGX-HDWLWNEUSA-N,"InChI=1S/C35H40O11/c1-20-17-27(42-21(2)36)30(44-23(4)38)34(19-41-31(39)24-13-9-7-10-14-24)28(45-32(40)25-15-11-8-12-16-25)18-26-29(43-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26-,27+,28+,29-,30+,34-,35-/m1/s1",CC(=O)O[C@H]1C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(COC(=O)c2ccccc2)[C@H]1OC(C)=O)[C@H]3OC(C)=O,C35H40O11,pos_1_sodium,636.2570620999999,DRSUFQXLYTXQGX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Elaeodendron buchananii,6092546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Elaeodendron'],['Elaeodendron buchananii'],6,0,6.0 4625,4033,-1,,,,0.0,MS1_match,DRSUFQXLYTXQGX-GKRDPSGZSA-N,"InChI=1S/C35H40O11/c1-20-17-27(42-21(2)36)30(44-23(4)38)34(19-41-31(39)24-13-9-7-10-14-24)28(45-32(40)25-15-11-8-12-16-25)18-26-29(43-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26+,27+,28+,29+,30+,34+,35+/m0/s1",CC(=O)O[C@@H]1[C@H](OC(C)=O)C[C@H](C)[C@]23OC(C)(C)[C@H](C[C@@H](OC(=O)c4ccccc4)[C@]12COC(=O)c1ccccc1)[C@H]3OC(C)=O,C35H40O11,pos_1_sodium,636.2570621,DRSUFQXLYTXQGX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Microtropis fokienensis,1015845.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis fokienensis'],6,0,6.0 4626,4033,-1,,,,0.0,MS1_match,DRSUFQXLYTXQGX-HDWLWNEUSA-N,"InChI=1S/C35H40O11/c1-20-17-27(42-21(2)36)30(44-23(4)38)34(19-41-31(39)24-13-9-7-10-14-24)28(45-32(40)25-15-11-8-12-16-25)18-26-29(43-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26-,27+,28+,29-,30+,34-,35-/m1/s1",CC(=O)O[C@H]1C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(COC(=O)c2ccccc2)[C@H]1OC(C)=O)[C@H]3OC(C)=O,C35H40O11,pos_1_sodium,636.2570620999999,DRSUFQXLYTXQGX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,0,6.0 4627,4033,-1,,,,0.0,MS1_match,DRSUFQXLYTXQGX-HDWLWNEUSA-N,"InChI=1S/C35H40O11/c1-20-17-27(42-21(2)36)30(44-23(4)38)34(19-41-31(39)24-13-9-7-10-14-24)28(45-32(40)25-15-11-8-12-16-25)18-26-29(43-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26-,27+,28+,29-,30+,34-,35-/m1/s1",CC(=O)O[C@H]1C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(COC(=O)c2ccccc2)[C@H]1OC(C)=O)[C@H]3OC(C)=O,C35H40O11,pos_1_sodium,636.2570620999999,DRSUFQXLYTXQGX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Elaeodendron buchananii,6092546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Elaeodendron'],['Elaeodendron buchananii'],6,0,6.0 4628,4033,-1,,,,0.0,MS1_match,NDGSLRUFUIEVLM-HDWLWNEUSA-N,"InChI=1S/C35H40O11/c1-20-17-27(44-31(39)24-13-9-7-10-14-24)30(43-23(4)38)34(19-41-21(2)36)28(45-32(40)25-15-11-8-12-16-25)18-26-29(42-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26-,27+,28+,29-,30+,34-,35-/m1/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)C[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@H](C)C[C@H](OC(=O)c1ccccc1)[C@@H]2OC(C)=O,C35H40O11,pos_1_sodium,636.2570620999999,NDGSLRUFUIEVLM,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,6.0 4629,4033,-1,,,,0.0,MS1_match,TXFGQQCHKBHRQF-UJWWHINYSA-N,"InChI=1S/C35H40O11/c1-20(36)42-27-28(39)34(6,41)35-29(43-21(2)37)24(32(3,4)46-35)19-25(44-26(38)18-17-22-13-9-7-10-14-22)33(35,5)30(27)45-31(40)23-15-11-8-12-16-23/h7-18,24-25,27-30,39,41H,19H2,1-6H3/b18-17+/t24-,25+,27-,28+,29-,30+,33-,34+,35-/m1/s1",CC(=O)O[C@H]1[C@H](OC(=O)c2ccccc2)[C@@]2(C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@H]3[C@@H](OC(C)=O)[C@]2(OC3(C)C)[C@@](C)(O)[C@H]1O,C35H40O11,pos_1_sodium,636.2570621,TXFGQQCHKBHRQF,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus jelskii,6092967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus jelskii'],6,0,6.0 4630,4033,-1,,,,0.0,MS1_match,RKQBXPZSTLHXPR-XFOFPURASA-N,"InChI=1S/C35H40O11/c1-20(36)42-24-19-33(5,41)35-28(39)26(32(3,4)46-35)27(44-25(38)18-17-22-13-9-7-10-14-22)30(34(35,6)29(24)43-21(2)37)45-31(40)23-15-11-8-12-16-23/h7-18,24,26-30,39,41H,19H2,1-6H3/b18-17+/t24-,26+,27-,28+,29-,30-,33-,34-,35-/m0/s1",CC(=O)O[C@H]1C[C@](C)(O)[C@]23OC(C)(C)[C@H]([C@H](OC(=O)/C=C/c4ccccc4)[C@H](OC(=O)c4ccccc4)[C@]2(C)[C@H]1OC(C)=O)[C@H]3O,C35H40O11,pos_1_sodium,636.2570621,RKQBXPZSTLHXPR,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,0,6.0 4631,4033,-1,,,,0.0,MS1_match,RKQBXPZSTLHXPR-XFOFPURASA-N,"InChI=1S/C35H40O11/c1-20(36)42-24-19-33(5,41)35-28(39)26(32(3,4)46-35)27(44-25(38)18-17-22-13-9-7-10-14-22)30(34(35,6)29(24)43-21(2)37)45-31(40)23-15-11-8-12-16-23/h7-18,24,26-30,39,41H,19H2,1-6H3/b18-17+/t24-,26+,27-,28+,29-,30-,33-,34-,35-/m0/s1",CC(=O)O[C@H]1C[C@](C)(O)[C@]23OC(C)(C)[C@H]([C@H](OC(=O)/C=C/c4ccccc4)[C@H](OC(=O)c4ccccc4)[C@]2(C)[C@H]1OC(C)=O)[C@H]3O,C35H40O11,pos_1_sodium,636.2570621,RKQBXPZSTLHXPR,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,0,6.0 4632,4033,-1,,,,0.0,MS1_match,NNIHOVDDAZGURH-ZAKGOMEISA-N,"InChI=1S/C35H40O11/c1-20(36)42-27-29(45-31(40)23-15-11-8-12-16-23)33(5)25(44-26(38)18-17-22-13-9-7-10-14-22)19-24-28(39)35(33,46-32(24,3)4)34(6,41)30(27)43-21(2)37/h7-18,24-25,27-30,39,41H,19H2,1-6H3/b18-17+/t24-,25+,27+,28-,29+,30+,33-,34+,35-/m1/s1",CC(=O)O[C@H]1[C@H](OC(=O)c2ccccc2)[C@@]2(C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@H]3[C@@H](O)[C@]2(OC3(C)C)[C@@](C)(O)[C@H]1OC(C)=O,C35H40O11,pos_1_sodium,636.2570621,NNIHOVDDAZGURH,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus jelskii,6092967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus jelskii'],6,0,6.0 4633,4033,-1,,,,0.0,MS1_match,CFCWERMAAXCFKA-OWYAAZHBSA-N,"InChI=1S/C35H40O11/c1-22(36)42-21-34-27(44-23(2)37)17-18-33(4,41)35(34)30(39)26(19-28(34)45-29(38)16-15-24-11-7-5-8-12-24)32(3,46-35)20-43-31(40)25-13-9-6-10-14-25/h5-16,26-28,30,39,41H,17-21H2,1-4H3/b16-15+/t26-,27+,28+,30-,32?,33+,34+,35+/m1/s1",CC(=O)OC[C@@]12[C@@H](OC(C)=O)CC[C@](C)(O)[C@]13OC(C)(COC(=O)c1ccccc1)[C@H](C[C@@H]2OC(=O)/C=C/c1ccccc1)[C@H]3O,C35H40O11,pos_1_sodium,636.2570621,CFCWERMAAXCFKA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Denhamia celastroides,806623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Denhamia'],['Denhamia celastroides'],6,0,6.0 4634,4032,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.24043147,ISDB,,,,,,,SCRNSJJNOIHPDO,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9617258906364441 4635,4028,635,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.20231597,ISDB,FMTLKIJHTZJTFK-UHFFFAOYSA-N,"InChI=1S/C25H18O12/c1-7-3-8-4-9-5-12(27)25(36-21(9)19(30)13(8)24(33)35-7)23(32)16-18(29)14-10(26)6-11(34-2)17(28)15(14)20(31)22(16)37-25/h3-4,6,12,23,26-28,30,32H,5H2,1-2H3",COc1cc(O)c2c(c1O)C(=O)C1=C(C2=O)C(O)C2(O1)Oc1c(cc3cc(C)oc(=O)c3c1O)CC2O,C25H18O12,,510.079826016,FMTLKIJHTZJTFK,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Streptomyces griseus,623861.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Streptomyces griseus'],0,3,2.3092638850212097 4636,4025,331,,,,0.39260095,ISDB,,,,,,,XBVKXOUBKPSYOS,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.570403814315796 4637,4023,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.30159676,ISDB,QURCVMIEKCOAJU-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+",COc1ccc(/C=C/C(=O)O)cc1O,C10H10O4,,194.0579088,QURCVMIEKCOAJU,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.706387042999268 4638,4021,678,Alkaloids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,CCTSZLOYMHLMHP-UHFFFAOYSA-N,"InChI=1S/C10H16O5/c1-10(14)7(12)2-6-5(3-11)4-15-9(13)8(6)10/h5-8,11-12,14H,2-4H2,1H3",CC1(O)C(O)CC2C(CO)COC(=O)C21,C10H16O5,pos_2MHNH3,216.099773612,CCTSZLOYMHLMHP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 4639,4016,-1,,,,0.0,MS1_match,KXDYPPVOPZKXMX-PEVLUNPASA-N,"InChI=1S/C21H24O11/c22-5-10-3-12(24)16-13(25)4-14-11(20(16)31-10)2-1-9(7-29-14)8-30-21-19(28)18(27)17(26)15(6-23)32-21/h1,3-4,15,17-19,21-23,25-28H,2,5-8H2/t15-,17-,18+,19-,21-/m1/s1",O=c1cc(CO)oc2c3c(cc(O)c12)OCC(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=CC3,C21H24O11,pos_1_1proton1acetonitrile,452.131861588,KXDYPPVOPZKXMX,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 4640,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,CAXLTZYEJPQCKD-SBQRELSASA-N,"InChI=1S/C33H40O21/c1-9-19(39)23(43)26(46)31(48-9)49-11-5-14(38)18-15(6-11)50-28(10-2-3-12(36)13(37)4-10)29(22(18)42)53-33-30(25(45)21(41)17(8-35)52-33)54-32-27(47)24(44)20(40)16(7-34)51-32/h2-6,9,16-17,19-21,23-27,30-41,43-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,30+,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083,CAXLTZYEJPQCKD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 4641,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 4642,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus rionii,593374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus rionii'],6,3,7.5 4643,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus hederaceus,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 4644,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 4645,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sphaerospermus,1033259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sphaerospermus'],6,3,7.5 4646,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis var. diffusus,5264025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 4647,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-HUGNALTDSA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9?,16?,17?,19-,20+,21+,23-,24-,25?,26?,27?,28?,31+,32+,33-/m0/s1",CC1O[C@@H](OCC2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)cc(O)c4c3=O)C(O)C(O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus ololeucos,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 4648,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis,491491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 4649,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus penicillatus,492327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus penicillatus'],6,3,7.5 4650,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus penicillatus,492327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus penicillatus'],6,3,7.5 4651,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 4652,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus hederaceus,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 4653,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 4654,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sphaerospermus,1033259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sphaerospermus'],6,3,7.5 4655,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis var. diffusus,5264025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 4656,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-HUGNALTDSA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9?,16?,17?,19-,20+,21+,23-,24-,25?,26?,27?,28?,31+,32+,33-/m0/s1",CC1O[C@@H](OCC2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)cc(O)c4c3=O)C(O)C(O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus ololeucos,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 4657,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_1potassium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,3,7.5 4658,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_1potassium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 4659,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_1potassium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,3,7.5 4660,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MGAFCXOXRHSKIA-WYXVZEBFSA-N,"InChI=1S/C33H40O21/c34-7-15-19(40)23(44)26(47)31(49-15)53-29-24(45)20(41)17(9-36)51-33(29)54-30-25(46)21(42)16(8-35)50-32(30)52-28-22(43)18-13(39)5-12(38)6-14(18)48-27(28)10-1-3-11(37)4-2-10/h1-6,15-17,19-21,23-26,29-42,44-47H,7-9H2/t15-,16-,17-,19-,20+,21-,23+,24+,25+,26-,29-,30-,31+,32+,33+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C33H40O21,pos_1_1potassium,772.2062083,MGAFCXOXRHSKIA,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 4661,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus rionii,593374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus rionii'],6,3,7.5 4662,4015,224,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,SPUFXPFDJYNCFD-YQJBXTIASA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,pos_1_1potassium,772.2062083000003,SPUFXPFDJYNCFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis,491491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 4663,4011,-1,,,,0.0,MS1_match,AZOXLPPOBHVORY-DKHHQGSCSA-N,"InChI=1S/C29H42O11/c1-14-22(33)23(34)24(35)25(39-14)40-16-3-6-27(13-30)21-18(4-7-28(27,36)10-16)29(37)8-5-17(15-9-20(32)38-12-15)26(29,2)11-19(21)31/h9,13-14,16-19,21-25,31,33-37H,3-8,10-12H2,1-2H3/t14-,16+,17-,18-,19-,21-,22+,23-,24-,25+,26-,27+,28+,29+/m1/s1",C[C@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4[C@H](O)C[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C29H42O11,pos_1_1proton1dmso,566.272712164,AZOXLPPOBHVORY,Terpenoids,Steroids,Cardenolides,Crossopetalum gaumeri,1091453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Crossopetalum'],['Crossopetalum gaumeri'],6,0,6.0 4664,4011,-1,,,,0.0,MS1_match,FLADIPPXZAQMOB-KDVZEOQNSA-N,"InChI=1S/C35H40O9/c1-21-19-27(42-29(38)18-17-24-13-9-7-10-14-24)31(41-23(3)37)34(6)28(43-32(39)25-15-11-8-12-16-25)20-26-30(40-22(2)36)35(21,34)44-33(26,4)5/h7-18,21,26-28,30-31H,19-20H2,1-6H3/b18-17+/t21-,26-,27+,28+,30-,31-,34-,35-/m1/s1",CC(=O)O[C@@H]1[C@@H](OC(=O)/C=C/c2ccccc2)C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]12C)[C@H]3OC(C)=O,C35H40O9,pos_1_1proton1acetonitrile,604.2672328599999,FLADIPPXZAQMOB,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,0,6.0 4665,4011,-1,,,,0.0,MS1_match,TYXXCCYTIZJOEY-HDYWKXFZSA-N,"InChI=1S/C35H40O9/c1-22-18-28(42-32(39)26-14-10-7-11-15-26)31(41-24(3)37)34(21-40-23(2)36)29(19-27-20-35(22,34)44-33(27,4)5)43-30(38)17-16-25-12-8-6-9-13-25/h6-17,22,27-29,31H,18-21H2,1-5H3/b17-16+/t22-,27-,28+,29+,31+,34-,35+/m1/s1",CC(=O)OC[C@]12[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@H]3C[C@]1(OC3(C)C)[C@H](C)C[C@H](OC(=O)c1ccccc1)[C@@H]2OC(C)=O,C35H40O9,pos_1_1proton1acetonitrile,604.2672328599999,TYXXCCYTIZJOEY,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,0,6.0 4666,4011,-1,,,,0.0,MS1_match,MDCKQLXQBJQOMX-LCEQPYDFSA-N,"InChI=1S/C35H40O9/c1-21-19-27(42-32(39)25-15-11-8-12-16-25)31(41-23(3)37)34(6)28(43-29(38)18-17-24-13-9-7-10-14-24)20-26-30(40-22(2)36)35(21,34)44-33(26,4)5/h7-18,21,26-28,30-31H,19-20H2,1-6H3/b18-17+/t21-,26-,27+,28+,30-,31+,34-,35-/m1/s1",CC(=O)O[C@@H]1[C@H]2C[C@H](OC(=O)/C=C/c3ccccc3)[C@]3(C)[C@@H](OC(C)=O)[C@@H](OC(=O)c4ccccc4)C[C@@H](C)[C@@]13OC2(C)C,C35H40O9,pos_1_1proton1acetonitrile,604.2672328599999,MDCKQLXQBJQOMX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,0,6.0 4667,4011,-1,,,,0.0,MS1_match,JBPHMRUWQMMAEK-PPDJSRMGSA-N,"InChI=1S/C35H40O9/c1-21-19-27(40-22(2)36)31(41-23(3)37)34(6)28(42-29(38)18-17-24-13-9-7-10-14-24)20-26-30(35(21,34)44-33(26,4)5)43-32(39)25-15-11-8-12-16-25/h7-18,21,26-28,30-31H,19-20H2,1-6H3/b18-17+/t21-,26-,27+,28-,30-,31+,34-,35-/m1/s1",CC(=O)O[C@H]1C[C@@H](C)[C@]23OC(C)(C)[C@H](C[C@@H](OC(=O)/C=C/c4ccccc4)[C@]2(C)[C@H]1OC(C)=O)[C@H]3OC(=O)c1ccccc1,C35H40O9,pos_1_1proton1acetonitrile,604.26723286,JBPHMRUWQMMAEK,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,6.0 4668,4009,-1,,,,0.0,MS1_match,ASKNNOPNSQXQPY-XIBVQPFYSA-N,"InChI=1S/C28H30O16/c1-10(29)41-25-15(33)8-39-27(23(25)38)40-9-17-19(34)21(36)22(37)28(43-17)44-26-20(35)18-14(32)6-13(31)7-16(18)42-24(26)11-2-4-12(30)5-3-11/h2-7,15,17,19,21-23,25,27-28,30-34,36-38H,8-9H2,1H3/t15-,17+,19+,21-,22+,23-,25-,27-,28-/m0/s1",CC(=O)O[C@@H]1[C@H](O)[C@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)OC[C@@H]1O,C28H30O16,pos_1_1proton2acetonitrile,622.15338488,ASKNNOPNSQXQPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Thalictrum atriplex,871204.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum atriplex'],6,0,6.0 4669,4001,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DJCYVGGVILUPNY-CNSIFVFBSA-N,"InChI=1S/C15H22O5/c1-7(2)15-10(17)6-14(4,19-20-15)12-9(16)5-8(3)11(12)13(15)18/h7-8,10,13,17-18H,5-6H2,1-4H3/t8-,10-,13+,14+,15+/m1/s1",CC(C)[C@]12OO[C@@](C)(C[C@H]1O)C1=C([C@H](C)CC1=O)[C@@H]2O,C15H22O5,pos_1_1proton1ammonium,282.146723804,DJCYVGGVILUPNY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 4670,4001,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DJCYVGGVILUPNY-MTVVJKOXSA-N,"InChI=1S/C15H22O5/c1-7(2)15-10(17)6-14(4,19-20-15)12-9(16)5-8(3)11(12)13(15)18/h7-8,10,13,17-18H,5-6H2,1-4H3/t8-,10+,13-,14-,15+/m1/s1",CC(C)[C@]12OO[C@](C)(C[C@@H]1O)C1=C([C@H](C)CC1=O)[C@H]2O,C15H22O5,pos_1_1proton1ammonium,282.146723804,DJCYVGGVILUPNY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4671,4000,-1,,,,0.0,MS1_match,RZKHWBQSRXGRFP-UHFFFAOYSA-N,"InChI=1S/C32H46O11/c1-9-18(3)26(34)40-23-15-30(8,37)32-14-22(29(6,7)43-32)13-24(41-28(36)21-11-12-38-16-21)31(32,17-39-20(5)33)25(23)42-27(35)19(4)10-2/h11-12,16,18-19,22-25,37H,9-10,13-15,17H2,1-8H3",CCC(C)C(=O)OC1CC(C)(O)C23CC(CC(OC(=O)c4ccoc4)C2(COC(C)=O)C1OC(=O)C(C)CC)C(C)(C)O3,C32H46O11,pos_1_1potassium,606.304012292,RZKHWBQSRXGRFP,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,0,7.0 4672,3998,-1,,,,0.27414262,ISDB,HKZQJZIFODOLFR-UHFFFAOYSA-N,"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h6H,4-5H2,1-3H3",CC1=CC(=O)C(=C(C)C)CC1,C10H14O,,150.104465068,HKZQJZIFODOLFR,Terpenoids,Monoterpenoids,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,8.096570491790771 4673,3996,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YQUVCSBJEUQKSH-UHFFFAOYSA-N,"InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)",O=C(O)c1ccc(O)c(O)c1,C7H6O4,pos_2MH,154.026608672,YQUVCSBJEUQKSH,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,1,8.5 4674,3994,-1,,,,0.65162283,ISDB,WCOGCXNOODOZBU-HNKCEKSGSA-N,"InChI=1S/C19H26O2/c1-11(20)14-6-7-19-16(14)8-9-17-15-5-3-13(21)10-12(15)2-4-18(17)19/h2,6,13,15-19,21H,3-5,7-10H2,1H3/t13-,15+,16+,17-,18-,19-/m0/s1",CC(=O)C1=CC[C@@H]2[C@H]3CC=C4C[C@@H](O)CC[C@H]4[C@@H]3CC[C@H]12,C19H26O2,,286.193280072,WCOGCXNOODOZBU,Terpenoids,Steroids,Pregnane steroids,Veratrum grandiflorum,1088325.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Melanthiaceae'],['Unknown'],['Veratrum'],['Veratrum grandiflorum'],4,0,6.606491327285767 4675,3987,-1,,,,0.0,MS1_match,UZSZTNKGIQMEOL-QGODIXMOSA-N,"InChI=1S/C39H60O12/c1-20(40)48-28-29-34(7)13-16-39(51-34,33(5,6)45)47-19-38(29)15-14-37-18-36(37)12-11-25(50-31-27(44)26(43)22(42)17-46-31)32(3,4)23(36)9-10-24(37)35(38,8)30(28)49-21(2)41/h22-31,42-45H,9-19H2,1-8H3/t22-,23+,24+,25+,26+,27-,28-,29-,30-,31+,34+,35-,36-,37+,38+,39+/m1/s1",CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@@]23CO[C@@]2(C(C)(C)O)CC[C@](C)(O2)[C@@H]13,C39H60O12,pos_3_3sodium,720.40847736,UZSZTNKGIQMEOL,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 4676,3985,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.36699483,ISDB,YYNVBNQMBDXSDX-ZVTXLDGASA-N,"InChI=1S/C25H42O12/c1-11-7-13(27)8-25(3,4)14(11)6-5-12(2)35-24-22(33)20(31)18(29)16(37-24)10-34-23-21(32)19(30)17(28)15(9-26)36-23/h7,12,14-24,26,28-33H,5-6,8-10H2,1-4H3/t12-,14+,15-,16-,17-,18-,19+,20+,21-,22-,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1CC[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H42O12,,534.267626784,YYNVBNQMBDXSDX,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Ornithogalum umbellatum,12152.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hyacinthaceae'],['Unknown'],['Ornithogalum'],['Ornithogalum umbellatum'],4,1,5.967979311943054 4677,3982,633,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Furocoumarins,0.0,MS1_match,MNWFXJYAOYHMED-UHFFFAOYSA-N,"InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)",CCCCCCC(=O)O,C7H14O2,pos_2MHNH3,130.099379688,MNWFXJYAOYHMED,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 4678,3982,633,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Furocoumarins,0.0,MS1_match,MNWFXJYAOYHMED-UHFFFAOYSA-N,"InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)",CCCCCCC(=O)O,C7H14O2,pos_2MHNH3,130.099379688,MNWFXJYAOYHMED,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 4679,3980,-1,,,,0.46665388,ISDB,KGKIGWBYVVWXME-LLVKDONJSA-N,"InChI=1S/C12H22O4/c1-10(13)7-5-3-2-4-6-8-11(14)9-12(15)16/h11,14H,2-9H2,1H3,(H,15,16)/t11-/m1/s1",CC(=O)CCCCCCC[C@@H](O)CC(=O)O,C12H22O4,,230.151809184,KGKIGWBYVVWXME,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Blepharizonia plumosa,1042864.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Madieae'],['Blepharizonia'],['Blepharizonia plumosa'],4,0,5.866615533828735 4680,3976,697,Polyketides,Aromatic polyketides,Catechols with side chains,0.4606768,ISDB,BENPXLIQKFYNHW-UHFFFAOYSA-N,"InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)20-24-21-26(29)23-27(30)22-24/h21-23,29-30H,2-20H2,1H3",CCCCCCCCCCCCCCCCCCCC(=O)Cc1cc(O)cc(O)c1,C27H46O3,,418.344695332,BENPXLIQKFYNHW,Polyketides,Aromatic polyketides,Catechols with side chains,Triticum aestivum,31926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Triticum'],['Triticum aestivum'],4,3,7.34270715713501 4681,3976,697,Polyketides,Aromatic polyketides,Catechols with side chains,0.4606768,ISDB,BENPXLIQKFYNHW-UHFFFAOYSA-N,"InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)20-24-21-26(29)23-27(30)22-24/h21-23,29-30H,2-20H2,1H3",CCCCCCCCCCCCCCCCCCCC(=O)Cc1cc(O)cc(O)c1,C27H46O3,,418.344695332,BENPXLIQKFYNHW,Polyketides,Aromatic polyketides,Catechols with side chains,Secale cereale,553015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Secale'],['Secale cereale'],4,3,7.34270715713501 4682,3974,-1,,,,0.0,MS1_match,AAJDHOXHRGMSLB-QCECGRHHSA-N,"InChI=1S/C14H28O8/c1-7(16)8(14(2,3)20)4-5-21-13-12(19)11(18)10(17)9(6-15)22-13/h7-13,15-20H,4-6H2,1-3H3/t7-,8-,9+,10+,11-,12+,13+/m0/s1",C[C@H](O)[C@H](CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O,C14H28O8,pos_1_1proton1acetonitrile,324.178417856,AAJDHOXHRGMSLB,Terpenoids,,,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,0,6.0 4683,3973,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.37820888,ISDB,CBEFWCLRPKIYCH-DKZZKAIRSA-N,"InChI=1S/C40H77NO8/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-30-36(44)41-33(32-48-40-39(47)38(46)37(45)35(31-42)49-40)34(43)29-27-25-23-21-19-14-12-10-8-6-4-2/h27,29,33-35,37-40,42-43,45-47H,3-26,28,30-32H2,1-2H3,(H,41,44)/b29-27+/t33-,34+,35+,37-,38-,39+,40+/m0/s1",CCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCC,C40H77NO8,,699.5649184239999,CBEFWCLRPKIYCH,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Turbo stenogyrus,714357.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Gastropoda'],['Unknown'],['Turbinidae'],['Unknown'],['Turbo'],['Turbo stenogyrus'],1,3,4.012835502624512 4684,3968,-1,,,,0.0,MS1_match,MIQIFBIWUBAPTB-KJQQCQNYSA-N,"InChI=1S/C42H58N2O/c1-36-8-5-9-42-32(36)7-11-39-21-40(25(16-33(39)42)15-30(39)34(42)44(4)23-36)12-13-41-29-17-28-26-14-24-18-37(2,22-43(3)20-24)27(26)6-10-38(28,19-31(29)41)35(41)45-40/h17,24-25,29-35H,5-16,18-23H2,1-4H3/t24?,25-,29+,30?,31?,32+,33+,34?,35-,36-,37-,38+,39+,40-,41+,42-/m0/s1",CN1CC2CC3=C(CC[C@@]45CC6[C@@H](C=C34)[C@]63CC[C@@]4(C[C@]67CC[C@@H]8[C@@]9(C)CCC[C@]8%10C(C6C[C@H]4C[C@H]7%10)N(C)C9)O[C@@H]53)[C@@](C)(C2)C1,C42H58N2O,pos_2_2sodium,606.454914476,MIQIFBIWUBAPTB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 4685,3968,-1,,,,0.0,MS1_match,MIQIFBIWUBAPTB-KJQQCQNYSA-N,"InChI=1S/C42H58N2O/c1-36-8-5-9-42-32(36)7-11-39-21-40(25(16-33(39)42)15-30(39)34(42)44(4)23-36)12-13-41-29-17-28-26-14-24-18-37(2,22-43(3)20-24)27(26)6-10-38(28,19-31(29)41)35(41)45-40/h17,24-25,29-35H,5-16,18-23H2,1-4H3/t24?,25-,29+,30?,31?,32+,33+,34?,35-,36-,37-,38+,39+,40-,41+,42-/m0/s1",CN1CC2CC3=C(CC[C@@]45CC6[C@@H](C=C34)[C@]63CC[C@@]4(C[C@]67CC[C@@H]8[C@@]9(C)CCC[C@]8%10C(C6C[C@H]4C[C@H]7%10)N(C)C9)O[C@@H]53)[C@@](C)(C2)C1,C42H58N2O,pos_2_2sodium,606.454914476,MIQIFBIWUBAPTB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 4686,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Flindersia maculosa,499504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Flindersia'],['Flindersia maculosa'],4,3,6.683994293212891 4687,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Boenninghausenia albiflora,239188.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Boenninghausenia'],['Boenninghausenia albiflora'],4,3,6.683994293212891 4688,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Clausena anisum-olens,5233135.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Clausena'],['Clausena anisum-olens'],4,3,6.683994293212891 4689,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Hydrangea febrifuga,221379.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea febrifuga'],4,3,6.683994293212891 4690,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Xenophyllum ciliolatum,7610033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Xenophyllum'],['Xenophyllum ciliolatum'],4,3,6.683994293212891 4691,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Zanthoxylum schinifolium,237365.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum schinifolium'],4,3,6.683994293212891 4692,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Citrus medica,798604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus medica'],4,3,6.683994293212891 4693,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Hydrangea chinensis,486966.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea chinensis'],4,3,6.683994293212891 4694,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Hydrangea macrophylla,162001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea macrophylla'],4,3,6.683994293212891 4695,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ayapana triplinervis,786810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Ayapana'],['Ayapana triplinervis'],4,3,6.683994293212891 4696,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia apiacea,119930.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia apiacea'],4,3,6.683994293212891 4697,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia carvifolia,846950.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia carvifolia'],4,3,6.683994293212891 4698,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia caruifolia,846950.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia carvifolia'],4,3,6.683994293212891 4699,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Sinacalia tangutica,1010095.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Sinacalia'],['Sinacalia tangutica'],4,3,6.683994293212891 4700,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Zanthoxylum ailanthoides,806818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum ailanthoides'],4,3,6.683994293212891 4701,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Flindersia dissosperma,1076073.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Flindersia'],['Flindersia dissosperma'],4,3,6.683994293212891 4702,3966,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29599857,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Daphne mezereum,912112.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Daphne'],['Daphne mezereum'],4,3,6.683994293212891 4703,3962,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_minus1proton2sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum revolutum,421843.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum revolutum'],6,0,6.0 4704,3962,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_minus1proton2sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 4705,3962,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_minus1proton2sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lucidum,977702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lucidum'],6,0,6.0 4706,3962,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_minus1proton2sodium,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum rugosum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 4707,3958,-1,,,,0.0,MS1_match,FZPVNGODHKVGGJ-MUSZMPNRSA-N,"InChI=1S/C17H24O8/c1-8(2)5-12(19)24-15-13-16(20)6-11(23-10(4)18)17(13,21)7-22-14(25-15)9(16)3/h8,11,13-15,20-21H,3,5-7H2,1-2,4H3/t11-,13-,14+,15+,16-,17-/m0/s1",C=C1[C@@H]2OC[C@]3(O)[C@@H](OC(C)=O)C[C@@]1(O)[C@@H]3[C@H](OC(=O)CC(C)C)O2,C17H24O8,pos_1_sodium,356.147117728,FZPVNGODHKVGGJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4708,3958,-1,,,,0.0,MS1_match,PWXSALGBFFRJCR-MNMQIZOCSA-N,"InChI=1S/C17H24O8/c1-8(2)5-12(19)22-7-17-11(23-10(4)18)6-16(21)9(3)15(25-17)24-14(20)13(16)17/h8,11,13-15,20-21H,3,5-7H2,1-2,4H3/t11-,13-,14+,15-,16-,17+/m0/s1",C=C1[C@H]2O[C@@H](O)[C@@H]3[C@](COC(=O)CC(C)C)(O2)[C@@H](OC(C)=O)C[C@]13O,C17H24O8,pos_1_sodium,356.147117728,PWXSALGBFFRJCR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4709,3951,-1,,,,0.0,MS1_match,FZPVNGODHKVGGJ-MUSZMPNRSA-N,"InChI=1S/C17H24O8/c1-8(2)5-12(19)24-15-13-16(20)6-11(23-10(4)18)17(13,21)7-22-14(25-15)9(16)3/h8,11,13-15,20-21H,3,5-7H2,1-2,4H3/t11-,13-,14+,15+,16-,17-/m0/s1",C=C1[C@@H]2OC[C@]3(O)[C@@H](OC(C)=O)C[C@@]1(O)[C@@H]3[C@H](OC(=O)CC(C)C)O2,C17H24O8,pos_1_1proton1ammonium,356.147117728,FZPVNGODHKVGGJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4710,3951,-1,,,,0.0,MS1_match,PWXSALGBFFRJCR-MNMQIZOCSA-N,"InChI=1S/C17H24O8/c1-8(2)5-12(19)22-7-17-11(23-10(4)18)6-16(21)9(3)15(25-17)24-14(20)13(16)17/h8,11,13-15,20-21H,3,5-7H2,1-2,4H3/t11-,13-,14+,15-,16-,17+/m0/s1",C=C1[C@H]2O[C@@H](O)[C@@H]3[C@](COC(=O)CC(C)C)(O2)[C@@H](OC(C)=O)C[C@]13O,C17H24O8,pos_1_1proton1ammonium,356.147117728,PWXSALGBFFRJCR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 4711,3950,69,Terpenoids,Sesquiterpenoids,Furans,0.64975935,ISDB,STIYXYABWPDGCS-PRLTYNAASA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(17)16(4)8-7-12-10(2)11(3)18-15(12)14(9)16/h5,10,12-15,17H,3,6-8H2,1-2,4H3/t10-,12+,13-,14-,15+,16+/m1/s1",C=C1O[C@H]2[C@@H](CC[C@@]3(C)[C@H](O)CC=C(C)[C@H]23)[C@@H]1C,C16H24O2,,248.177630008,STIYXYABWPDGCS,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Artemisia inculta,969157.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia inculta'],4,2,7.599037408828735 4712,3946,-1,,,,0.5475425,ISDB,MUQCDEGKKWQCAO-UHFFFAOYSA-N,"InChI=1S/C11H14O2/c1-2-9-3-5-10(6-4-9)7-8-11(12)13/h3-6H,2,7-8H2,1H3,(H,12,13)",CCc1ccc(CCC(=O)O)cc1,C11H14O2,,178.099379688,MUQCDEGKKWQCAO,,,,Cannabis sativa,84004.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Cannabis'],['Cannabis sativa'],4,0,6.190170049667358 4713,3943,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1proton1acetonitrile,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 4714,3941,44,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QUKURLODOVRHQB-CSIVPCFASA-N,"InChI=1S/C23H37NO9/c1-24-7-20(8-31-2)10(25)5-11(32-3)22-9-6-21(29)17(26)12(9)23(30,19(28)18(21)27)13(16(22)24)14(33-4)15(20)22/h9-19,25-30H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14+,15-,16-,17-,18+,19+,20+,21-,22+,23-/m1/s1",COC[C@]12CN(C)[C@@H]3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](O)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2O,C23H37NO9,pos_1_1proton1methanol,471.2468317639998,QUKURLODOVRHQB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 4715,3940,-1,,,,0.29515973,ISDB,WVHAUDNUGBNUDZ-GOVZDWNOSA-N,"InChI=1S/C12H14O7/c13-7-8(14)10(11(16)17)19-12(9(7)15)18-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9+,10-,12+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O,C12H14O7,,270.073952788,WVHAUDNUGBNUDZ,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,5.180638909339905 4716,3937,-1,,,,0.0,MS1_match,VISDUEJJQYPGIZ-UHFFFAOYSA-N,"InChI=1S/C13H16N2O4/c1-8(7-11(14)16)12(17)15-10-6-4-3-5-9(10)13(18)19-2/h3-6,8H,7H2,1-2H3,(H2,14,16)(H,15,17)",COC(=O)c1ccccc1NC(=O)C(C)CC(N)=O,C13H16N2O4,pos_1_1proton1ethylamine,264.111006992,VISDUEJJQYPGIZ,Alkaloids,Anthranilic acid alkaloids,Anthranillic acid derivatives,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 4717,3935,-1,,,,0.0,MS1_match,OGOVVRHSMHRFIK-MYEWIJLCSA-N,"InChI=1S/C22H22O12/c1-32-15-8-11(9-16(33-2)18(15)26)4-6-17(25)34-19(20(27)28)22(31,21(29)30)10-12-3-5-13(23)14(24)7-12/h3-9,19,23-24,26,31H,10H2,1-2H3,(H,27,28)(H,29,30)/b6-4+/t19-,22-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc(OC)c1O,C22H22O12,pos_1_1proton2acetonitrile,478.1111261439999,OGOVVRHSMHRFIK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 4718,3933,296,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,0.0,MS1_match,SFHWHWVEDBDXLV-AWEZNQCLSA-N,"InChI=1S/C22H25NO6/c1-23-7-6-11-16-14(23)8-13-12(9-15(24-2)20(27-5)19(13)26-4)17(16)21-22(18(11)25-3)29-10-28-21/h9,14H,6-8,10H2,1-5H3/t14-/m0/s1",COc1cc2c(c(OC)c1OC)C[C@H]1c3c(c(OC)c4c(c3-2)OCO4)CCN1C,C22H25NO6,pos_3_3proton,399.16818752,SFHWHWVEDBDXLV,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum delavayi,619774.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum delavayi'],6,3,7.5 4719,3933,296,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,0.0,MS1_match,SFHWHWVEDBDXLV-AWEZNQCLSA-N,"InChI=1S/C22H25NO6/c1-23-7-6-11-16-14(23)8-13-12(9-15(24-2)20(27-5)19(13)26-4)17(16)21-22(18(11)25-3)29-10-28-21/h9,14H,6-8,10H2,1-5H3/t14-/m0/s1",COc1cc2c(c(OC)c1OC)C[C@H]1c3c(c(OC)c4c(c3-2)OCO4)CCN1C,C22H25NO6,pos_3_3proton,399.16818752,SFHWHWVEDBDXLV,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,3,7.5 4720,3930,-1,,,,0.0,MS1_match,ZZFJSWIPFJPKST-UHFFFAOYSA-N,"InChI=1S/C35H40O12/c1-20(36)42-19-34-27(46-31(40)24-15-11-8-12-16-24)17-25-28(43-21(2)37)35(34,47-32(25,4)5)33(6,41)18-26(29(34)44-22(3)38)45-30(39)23-13-9-7-10-14-23/h7-16,25-29,41H,17-19H2,1-6H3",CC(=O)OCC12C(OC(=O)c3ccccc3)CC3C(OC(C)=O)C1(OC3(C)C)C(C)(O)CC(OC(=O)c1ccccc1)C2OC(C)=O,C35H40O12,pos_1_1proton,652.25197672,ZZFJSWIPFJPKST,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus sachalinensis,598270.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus sachalinensis'],7,0,7.0 4721,3930,-1,,,,0.0,MS1_match,OCOXCQAMJXUUGB-OCRATEHUSA-N,"InChI=1S/C35H40O12/c1-20(36)42-19-34-27(43-21(2)37)17-25-28(44-22(3)38)35(34,47-32(25,4)5)33(6,41)18-26(45-30(39)23-13-9-7-10-14-23)29(34)46-31(40)24-15-11-8-12-16-24/h7-16,25-29,41H,17-19H2,1-6H3/t25-,26+,27+,28-,29+,33+,34-,35+/m1/s1",CC(=O)OC[C@]12[C@@H](OC(C)=O)C[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(=O)c1ccccc1)[C@@H]2OC(=O)c1ccccc1,C35H40O12,pos_1_1proton,652.25197672,OCOXCQAMJXUUGB,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,0,7.0 4722,3929,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ANFCLBKOBMSSLU-FQLXRVMXSA-N,"InChI=1S/C37H36N2O7/c1-38-12-11-23-16-33(44-3)36-27-17-25-26(18-31(27)43-2)34(45-4)19-39(20-40)28(25)13-21-5-8-24(9-6-21)46-32-15-22(7-10-30(32)41)14-29(38)35(23)37(36)42/h5-10,15-20,28-29,41-42H,11-14H2,1-4H3/t28-,29-/m1/s1",COC1=CN(C=O)[C@@H]2Cc3ccc(cc3)Oc3cc(ccc3O)C[C@@H]3c4c(cc(OC)c(c4O)-c4cc2c1cc4OC)CCN3C,C37H36N2O7,pos_2_2proton2acetonitrile,620.252251492,ANFCLBKOBMSSLU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Isopyrum thalictroides,949657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Isopyrum'],['Isopyrum thalictroides'],6,0,6.0 4723,3928,-1,,,,0.40621513,ISDB,LWUAWGAZJRITSG-UHFFFAOYSA-N,"InChI=1S/C25H32N4O6/c1-35-22-14-17(8-9-21(22)31)15-23(32)27-11-4-5-12-28-24(33)16-25(34)29-13-10-20(30)18-6-2-3-7-19(18)26/h2-3,6-9,14,31H,4-5,10-13,15-16,26H2,1H3,(H,27,32)(H,28,33)(H,29,34)",COc1cc(CC(=O)NCCCCNC(=O)CC(=O)NCCC(=O)c2ccccc2N)ccc1O,C25H32N4O6,,484.232184744,LWUAWGAZJRITSG,Alkaloids,Ornithine alkaloids,Polyamines,Monodonta labio,662766.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Gastropoda'],['Unknown'],['Trochidae'],['Unknown'],['Monodonta'],['Monodonta labio'],1,0,2.6248605251312256 4724,3927,36,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,AHOMFGXCQWFXTC-SSEXGKCCSA-N,"InChI=1S/C36H36N2O5/c1-38-15-13-25-20-33(40-3)35(41-4)36-34(25)30(38)18-23-6-5-7-27(16-23)42-26-10-8-22(9-11-26)17-29-28-21-31(39-2)32(43-36)19-24(28)12-14-37-29/h5-11,16,19-21,30H,12-15,17-18H2,1-4H3/t30-/m1/s1",COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1cccc(c1)Oc1ccc(cc1)CC2=NCC3)N(C)CC4,C36H36N2O5,pos_1_1potassium,576.262422252,AHOMFGXCQWFXTC,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 4725,3926,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.23665673,ISDB,BGWXCNUGXLABMC-UHFFFAOYSA-N,"InChI=1S/C10H12O4/c1-4-5-3-6(11)10(2)7(5)8(12)13-9(4)14-10/h5-7,9,11H,1,3H2,2H3",C=C1C2OC(=O)C3C1CC(O)C3(C)O2,C10H12O4,,196.073558864,BGWXCNUGXLABMC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,8.446626901626587 4726,3922,-1,,,,0.38722184,ISDB,,,,,,,HFQPKOQLZSCHPI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5488873720169067 4727,3920,-1,,,,0.0,MS1_match,IGWDEVSBEKYORK-UHFFFAOYSA-N,"InChI=1S/C16H14O4/c1-10(2)5-7-19-16-11-3-4-15(17)20-14(11)9-13-12(16)6-8-18-13/h3-6,8-9H,7H2,1-2H3",CC(C)=CCOc1c2ccoc2cc2oc(=O)ccc12,C16H14O4,pos_1_1proton1methanol,270.089208928,IGWDEVSBEKYORK,Shikimates and Phenylpropanoids,Coumarins,Furocoumarins,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 4728,3920,-1,,,,0.0,MS1_match,IGWDEVSBEKYORK-UHFFFAOYSA-N,"InChI=1S/C16H14O4/c1-10(2)5-7-19-16-11-3-4-15(17)20-14(11)9-13-12(16)6-8-18-13/h3-6,8-9H,7H2,1-2H3",CC(C)=CCOc1c2ccoc2cc2oc(=O)ccc12,C16H14O4,pos_1_1proton1methanol,270.089208928,IGWDEVSBEKYORK,Shikimates and Phenylpropanoids,Coumarins,Furocoumarins,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 4729,3915,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.6402752,ISDB,KVRQQFBSAHPTAB-ATLLRHMBSA-N,"InChI=1S/C11H18O9/c1-4(5(14)2-12)10(18)20-11-9(17)8(16)7(15)6(3-13)19-11/h5-9,11-17H,1-3H2/t5-,6-,7-,8+,9-,11+/m1/s1",C=C(C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C11H18O9,,294.095082156,KVRQQFBSAHPTAB,Fatty acids,Fatty acyl glycosides,Fatty acyl glycosides of mono- and disaccharides,Tulipa gesneriana,878707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Tulipa'],['Tulipa gesneriana'],4,0,6.561100721359253 4730,3914,-1,,,,0.5297698,ISDB,LLNYPTNRKTUNSC-QXAKKESOSA-N,"InChI=1S/C19H18O4/c1-20-18-14-8-9-15-13(10-11-22-15)17(14)23-16(19(18)21-2)12-6-4-3-5-7-12/h3-11,16,18-19H,1-2H3/t16-,18+,19+/m0/s1",CO[C@H]1[C@H](OC)c2ccc3occc3c2O[C@H]1c1ccccc1,C19H18O4,,310.120509056,LLNYPTNRKTUNSC,Shikimates and Phenylpropanoids,Flavonoids,Flavandiols (Leucoanthocyanidins),Hebestigma cubense,1085819.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Robinieae'],['Hebestigma'],['Hebestigma cubense'],4,0,6.119079113006592 4731,3914,-1,,,,0.5297698,ISDB,LLNYPTNRKTUNSC-QXAKKESOSA-N,"InChI=1S/C19H18O4/c1-20-18-14-8-9-15-13(10-11-22-15)17(14)23-16(19(18)21-2)12-6-4-3-5-7-12/h3-11,16,18-19H,1-2H3/t16-,18+,19+/m0/s1",CO[C@H]1[C@H](OC)c2ccc3occc3c2O[C@H]1c1ccccc1,C19H18O4,,310.120509056,LLNYPTNRKTUNSC,Shikimates and Phenylpropanoids,Flavonoids,Flavandiols (Leucoanthocyanidins),Lonchocarpus heptaphyllus,922295.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Millettieae'],['Lonchocarpus'],['Lonchocarpus heptaphyllus'],4,0,6.119079113006592 4732,3912,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.4691855,ISDB,,,,,,,DTTFADJLKIVYMT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.8767420053482056 4733,3911,-1,,,,0.25957817,ISDB,,,,,,,PIVRTBXMRRPWIP,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0383126735687256 4734,3909,1302,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,ULSUXBXHSYSGDT-UHFFFAOYSA-N,"InChI=1S/C20H20O7/c1-22-12-8-6-11(7-9-12)14-10-13(21)15-16(23-2)18(24-3)20(26-5)19(25-4)17(15)27-14/h6-10H,1-5H3",COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1,C20H20O7,pos_1_1proton1methanol,372.1209029799999,ULSUXBXHSYSGDT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,3,9.5 4735,3908,-1,,,,0.0,MS1_match,OEOIWYCWCDBOPA-UHFFFAOYSA-N,"InChI=1S/C8H16O2/c1-7(2)5-3-4-6-8(9)10/h7H,3-6H2,1-2H3,(H,9,10)",CC(C)CCCCC(=O)O,C8H16O2,pos_1_1proton1acetonitrile,144.115029752,OEOIWYCWCDBOPA,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 4736,3908,-1,,,,0.0,MS1_match,OEOIWYCWCDBOPA-UHFFFAOYSA-N,"InChI=1S/C8H16O2/c1-7(2)5-3-4-6-8(9)10/h7H,3-6H2,1-2H3,(H,9,10)",CC(C)CCCCC(=O)O,C8H16O2,pos_1_1proton1acetonitrile,144.115029752,OEOIWYCWCDBOPA,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 4737,3907,1321,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5230016,ISDB,QPJPDAWUDLZIDJ-UHFFFAOYSA-N,"InChI=1S/C20H22O5/c1-5-6-13-10-20(25-4)11(2)16(17(18(13)22)19(20)23)12-7-8-14(21)15(9-12)24-3/h5,7-11,16-17,21H,1,6H2,2-4H3",C=CCC1=CC2(OC)C(=O)C(C1=O)C(c1ccc(O)c(OC)c1)C2C,C20H22O5,,342.146723804,QPJPDAWUDLZIDJ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Magnolia liliiflora,288469.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Magnoliaceae'],['Unknown'],['Magnolia'],['Magnolia liliiflora'],0,3,3.5920064449310303 4738,3905,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.28334892,ISDB,GSDRPXSKFIANKI-BEVHKJLDSA-N,"InChI=1S/C12H22O3/c1-8(13)4-5-10-11(15)6-9(14)7-12(10,2)3/h4-5,8-11,13-15H,6-7H2,1-3H3/b5-4+/t8-,9-,10+,11-/m1/s1",C[C@@H](O)/C=C/[C@H]1[C@H](O)C[C@@H](O)CC1(C)C,C12H22O3,,214.156894564,GSDRPXSKFIANKI,Terpenoids,Apocarotenoids,Megastigmanes,Phyllanthus lawii,759796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Phyllanthus'],['Phyllanthus lawii'],4,1,5.633395671844482 4739,3905,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.28334892,ISDB,GSDRPXSKFIANKI-BEVHKJLDSA-N,"InChI=1S/C12H22O3/c1-8(13)4-5-10-11(15)6-9(14)7-12(10,2)3/h4-5,8-11,13-15H,6-7H2,1-3H3/b5-4+/t8-,9-,10+,11-/m1/s1",C[C@@H](O)/C=C/[C@H]1[C@H](O)C[C@@H](O)CC1(C)C,C12H22O3,,214.156894564,GSDRPXSKFIANKI,Terpenoids,Apocarotenoids,Megastigmanes,Phyllanthus polyphyllus,69050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Phyllanthus'],['Phyllanthus polyphyllus'],4,1,5.633395671844482 4740,3904,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.2972201,ISDB,DLHGNEVRISSXIV-UHFFFAOYSA-N,"InChI=1S/C10H8O3/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5,11H,1H3",Cc1cc(=O)c2cccc(O)c2o1,C10H8O3,,176.047344116,DLHGNEVRISSXIV,Polyketides,Chromanes,Chromones,Halenia elliptica,862722.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Halenia'],['Halenia elliptica'],4,0,5.188880443572998 4741,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Carica papaya,429474.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Caricaceae'],['Unknown'],['Carica'],['Carica papaya'],4,0,6.505302667617798 4742,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Hedera helix,524074.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Hedera'],['Hedera helix'],4,0,6.505302667617798 4743,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Trifolium repens,116218.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trifolium'],['Trifolium repens'],4,0,6.505302667617798 4744,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Thymus transcaucasicus,6084067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymus'],['Thymus transcaucasicus'],4,0,6.505302667617798 4745,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Trifolium pratense,839027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trifolium'],['Trifolium pratense'],4,0,6.505302667617798 4746,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lunaria annua,464805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Biscutelleae'],['Lunaria'],['Lunaria annua'],4,0,6.505302667617798 4747,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Paris fargesii,1091123.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Melanthiaceae'],['Unknown'],['Paris'],['Paris fargesii'],4,0,6.505302667617798 4748,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Punica granatum,646814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Punica'],['Punica granatum'],4,0,6.505302667617798 4749,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],4,0,6.505302667617798 4750,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Astragalus falcatus,868704.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Astragalus'],['Astragalus falcatus'],4,0,6.505302667617798 4751,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Oryza sativa,709894.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Oryzeae'],['Oryza'],['Oryza sativa'],4,0,6.505302667617798 4752,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,0,6.505302667617798 4753,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Medicago sativa,1086789.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Medicago'],['Medicago sativa'],4,0,6.505302667617798 4754,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Paris polyphylla,597425.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Melanthiaceae'],['Unknown'],['Paris'],['Paris polyphylla'],4,0,6.505302667617798 4755,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Ficus septica,100094.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Ficus'],['Ficus septica'],4,0,6.505302667617798 4756,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,0,6.505302667617798 4757,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Spinacia oleracea,317784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Anserineae'],['Spinacia'],['Spinacia oleracea'],4,0,6.505302667617798 4758,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Ocotea velloziana,1050964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Ocotea'],['Ocotea velloziana'],4,0,6.505302667617798 4759,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Arnica montana,942734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Madieae'],['Arnica'],['Arnica montana'],4,0,6.505302667617798 4760,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Apium graveolens,2472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,0,6.505302667617798 4761,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Pseudostellaria heterophylla,698777.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Alsineae'],['Pseudostellaria'],['Pseudostellaria heterophylla'],4,0,6.505302667617798 4762,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lemna perpusilla,483451.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Araceae'],['Unknown'],['Lemna'],['Lemna perpusilla'],4,0,6.505302667617798 4763,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Morus australis,210689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus australis'],4,0,6.505302667617798 4764,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Morus bombycis,210686.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus bombycis'],4,0,6.505302667617798 4765,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Morus indica,307703.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus indica'],4,0,6.505302667617798 4766,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,0,6.505302667617798 4767,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Calendula officinalis,768229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Calenduleae'],['Calendula'],['Calendula officinalis'],4,0,6.505302667617798 4768,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Triticum aestivum,31926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Triticum'],['Triticum aestivum'],4,0,6.505302667617798 4769,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Telekia speciosa,959562.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Telekia'],['Telekia speciosa'],4,0,6.505302667617798 4770,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Helianthus annuus,515712.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Helianthus'],['Helianthus annuus'],4,0,6.505302667617798 4771,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Artemisia absinthium,707473.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia absinthium'],4,0,6.505302667617798 4772,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Castanea sativa,1028994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Castanea'],['Castanea sativa'],4,0,6.505302667617798 4773,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],4,0,6.505302667617798 4774,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lupinus luteus,1086811.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Genisteae'],['Lupinus'],['Lupinus luteus'],4,0,6.505302667617798 4775,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Bambusa vulgaris,1087322.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Bambuseae'],['Bambusa'],['Bambusa vulgaris'],4,0,6.505302667617798 4776,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,6.505302667617798 4777,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Gossypium hirsutum,854480.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Gossypium'],['Gossypium hirsutum'],4,0,6.505302667617798 4778,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Convolvulus arvensis,1071032.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Convolvulaceae'],['Convolvuleae'],['Convolvulus'],['Convolvulus arvensis'],4,0,6.505302667617798 4779,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Capsella bursa-pastoris,833644.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Capsella'],['Capsella bursa-pastoris'],4,0,6.505302667617798 4780,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lotus burttii,152567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus burttii'],4,0,6.505302667617798 4781,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lotus tenuis,484504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus tenuis'],4,0,6.505302667617798 4782,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lotus creticus,472038.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus creticus'],4,0,6.505302667617798 4783,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lotus corniculatus,183572.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus corniculatus'],4,0,6.505302667617798 4784,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lotus filicaulis,653433.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus filicaulis'],4,0,6.505302667617798 4785,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,0,6.505302667617798 4786,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Psychotria punctata,171145.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Psychotrieae'],['Psychotria'],['Psychotria punctata'],4,0,6.505302667617798 4787,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Atalantia buxifolia,778057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Atalantia'],['Atalantia buxifolia'],4,0,6.505302667617798 4788,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Ardisia crenata,776705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia crenata'],4,0,6.505302667617798 4789,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Prunus avium,162547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus avium'],4,0,6.505302667617798 4790,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Pisum sativum,359905.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Pisum'],['Pisum sativum'],4,0,6.505302667617798 4791,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Angelica gigas,941676.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Angelica'],['Angelica gigas'],4,0,6.505302667617798 4792,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Opuntia ficus-indica,396274.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Cactaceae'],['Unknown'],['Opuntia'],['Opuntia ficus-indica'],4,0,6.505302667617798 4793,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Allium sativum,748370.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium sativum'],4,0,6.505302667617798 4794,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Withania somnifera,374058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Physaleae'],['Withania'],['Withania somnifera'],4,0,6.505302667617798 4795,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lotus japonicus,1081728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus japonicus'],4,0,6.505302667617798 4796,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Cajanus cajan,612448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Cajanus'],['Cajanus cajan'],4,0,6.505302667617798 4797,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,0,6.505302667617798 4798,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Psophocarpus tetragonolobus,116244.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Psophocarpus'],['Psophocarpus tetragonolobus'],4,0,6.505302667617798 4799,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-REOHCLBHSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1",NC(=O)C[C@H](N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,0,6.505302667617798 4800,3900,-1,,,,0.62632567,ISDB,DCXYFEDJOCDNAF-UHFFFAOYSA-N,"InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)",NC(=O)CC(N)C(=O)O,C4H8N2O3,,132.053492116,DCXYFEDJOCDNAF,Amino acids and Peptides,Small peptides,Aminoacids,Lemna aequinoctialis,290.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Araceae'],['Unknown'],['Lemna'],['Lemna aequinoctialis'],4,0,6.505302667617798 4801,3897,-1,,,,0.0,MS1_match,WBCKSAACKDSJQC-UHFFFAOYSA-N,"InChI=1S/C17H22O7/c1-10(2)6-14(20)24-17(8-22-11(3)19)9-23-16(21)15-12(7-18)4-5-13(15)17/h4-5,7,10,15-16,21H,6,8-9H2,1-3H3",CC(=O)OCC1(OC(=O)CC(C)C)COC(O)C2C(C=O)=CC=C21,C17H22O7,pos_2MHCH3CN,338.136553044,WBCKSAACKDSJQC,Terpenoids,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4802,3895,216,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,QTZXVESWHBGRDB-MGHIWKHDSA-N,"InChI=1S/C32H42O18/c1-12-17(8-14-15(29(42)43)11-45-30(22(12)14)50-32-28(41)26(39)24(37)20(10-34)49-32)46-21(35)6-4-13-3-5-16(18(7-13)44-2)47-31-27(40)25(38)23(36)19(9-33)48-31/h3-7,11-12,14,17,19-20,22-28,30-34,36-41H,8-10H2,1-2H3,(H,42,43)/b6-4+/t12-,14-,17+,19+,20+,22+,23+,24+,25-,26-,27+,28+,30-,31-,32-/m0/s1",COc1cc(/C=C/C(=O)O[C@@H]2C[C@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)ccc1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H42O18,pos_2_2sodium,714.237114504,QTZXVESWHBGRDB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 4803,3894,-1,,,,0.0,MS1_match,IVEJLNJNUGZYTG-UKMCQSRUSA-N,"InChI=1S/C24H23N3O7/c28-10-17-19(29)20(30)21(31)24(34-17)33-11-5-6-12-13-7-8-27-22(18(13)25-16(12)9-11)26-15-4-2-1-3-14(15)23(27)32/h1-6,9,17,19-21,24-25,28-31H,7-8,10H2/t17-,19-,20+,21-,24-/m1/s1",O=c1c2ccccc2nc2n1CCc1c-2[nH]c2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12,C24H23N3O7,pos_1_minus1proton2sodium,465.1536000759999,IVEJLNJNUGZYTG,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Ranunculus ternatus,685195.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus ternatus'],6,0,6.0 4804,3893,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.40275997,ISDB,SZNQPFAEOXCITM-PWBFPFQSSA-N,"InChI=1S/C12H22O3/c1-5-10(9(2)3)6-7-12(4,15)8-11(13)14/h6-7,9-10,15H,5,8H2,1-4H3,(H,13,14)/b7-6+/t10-,12-/m1/s1",CC[C@H](/C=C/[C@@](C)(O)CC(=O)O)C(C)C,C12H22O3,,214.156894564,SZNQPFAEOXCITM,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,5.611039876937866 4805,3883,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.48805118,ISDB,NWOCYFGKUMMLPD-IIYHAVRMSA-N,"InChI=1S/C36H36O20/c37-11-22-26(46)29(49)33(54-24(45)6-2-13-1-4-16(40)18(42)7-13)35(52-22)56-34-30(50)27(47)23(12-38)53-36(34)55-32-28(48)25-20(44)9-15(39)10-21(25)51-31(32)14-3-5-17(41)19(43)8-14/h1-10,22-23,26-27,29-30,33-44,46-47,49-50H,11-12H2/b6-2+/t22-,23-,26+,27+,29+,30-,33-,34+,35-,36-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@@H](CO)[C@@H](O)[C@@H]2O)O[C@@H](CO)[C@@H](O)[C@H]1O,C36H36O20,,788.179993552,NWOCYFGKUMMLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus,387812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Unknown'],6,2,8.952204704284668 4806,3883,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.48805118,ISDB,NWOCYFGKUMMLPD-ZJNIXLGPSA-N,"InChI=1S/C36H36O20/c37-11-22-26(46)29(49)33(54-24(45)6-2-13-1-4-16(40)18(42)7-13)35(52-22)56-34-30(50)27(47)23(12-38)53-36(34)55-32-28(48)25-20(44)9-15(39)10-21(25)51-31(32)14-3-5-17(41)19(43)8-14/h1-10,22-23,26-27,29-30,33-44,46-47,49-50H,11-12H2/b6-2+/t22-,23-,26-,27-,29+,30+,33-,34-,35+,36+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C36H36O20,,788.179993552,NWOCYFGKUMMLPD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,2,8.952204704284668 4807,3882,-1,,,,0.0,MS1_match,UZSZTNKGIQMEOL-QGODIXMOSA-N,"InChI=1S/C39H60O12/c1-20(40)48-28-29-34(7)13-16-39(51-34,33(5,6)45)47-19-38(29)15-14-37-18-36(37)12-11-25(50-31-27(44)26(43)22(42)17-46-31)32(3,4)23(36)9-10-24(37)35(38,8)30(28)49-21(2)41/h22-31,42-45H,9-19H2,1-8H3/t22-,23+,24+,25+,26+,27-,28-,29-,30-,31+,34+,35-,36-,37+,38+,39+/m1/s1",CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@@]23CO[C@@]2(C(C)(C)O)CC[C@](C)(O2)[C@@H]13,C39H60O12,pos_2_1proton1sodium,720.40847736,UZSZTNKGIQMEOL,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 4808,3879,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.5921212,ISDB,DOFYAVLOCYRMIV-ULTRRKBWSA-N,"InChI=1S/C36H38N4O6/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)45-7)32(39-25)31-33-30(34(42)36(31,44)35(43)46-8)19(6)26(40-33)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,37,40,44H,1,10-12H2,2-8H3/t18-,22-,36-/m0/s1",C=Cc1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C)=C6CC)c(C)c5C(=O)[C@]4(O)C(=O)OC)[C@@H](CCC(=O)OC)[C@@H]3C,C36H38N4O6,,622.2791349360001,DOFYAVLOCYRMIV,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Clerodendrum calamitosum,6086132.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum calamitosum'],4,3,7.868484735488892 4809,3874,515,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1ammonium,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 4810,3872,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.27688673,ISDB,MHXCIKYXNYCMHY-AUSJPIAWSA-N,"InChI=1S/C20H24O6/c1-24-18-8-12(3-5-16(18)22)7-14-11-26-20(15(14)10-21)13-4-6-17(23)19(9-13)25-2/h3-6,8-9,14-15,20-23H,7,10-11H2,1-2H3/t14-,15-,20+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O)c(OC)c3)[C@H]2CO)ccc1O,C20H24O6,,360.157288488,MHXCIKYXNYCMHY,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,2,8.107546925544739 4811,3870,-1,,,,0.0,MS1_match,AZUURFWEIQDHCN-MZGJNUFDSA-N,"InChI=1S/C40H44O22/c1-14-25(46)29(50)31(52)38(55-14)56-17-10-20(45)24-21(11-17)57-33(16-7-8-18(43)19(44)9-16)35(28(24)49)61-40-36(30(51)26(47)22(12-41)59-40)62-39-32(53)34(27(48)23(13-42)58-39)60-37(54)15-5-3-2-4-6-15/h2-11,14,22-23,25-27,29-32,34,36,38-48,50-53H,12-13H2,1H3/t14-,22+,23+,25-,26+,27+,29+,30-,31+,32+,34-,36+,38+,39-,40-/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](OC(=O)c5ccccc5)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C40H44O22,pos_1_sodium,876.232423048,AZUURFWEIQDHCN,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium carolinianum,529153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carolinianum'],6,0,6.0 4812,3864,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,VQCXCCMCKDSXMQ-UHFFFAOYSA-N,"InChI=1S/C17H14O5/c1-9-13(21-2)8-15-16(17(9)20)12(19)7-14(22-15)10-3-5-11(18)6-4-10/h3-8,18,20H,1-2H3",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1C,C17H14O5,pos_2MH,298.084123548,VQCXCCMCKDSXMQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,2,7.0 4813,3864,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,IFIBDPUYMKDGNN-UHFFFAOYSA-N,"InChI=1S/C17H14O5/c1-9-14(21-2)7-12(19)16-13(20)8-15(22-17(9)16)10-3-5-11(18)6-4-10/h3-8,18-19H,1-2H3",COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1C,C17H14O5,pos_2MH,298.084123548,IFIBDPUYMKDGNN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,2,7.0 4814,3864,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,YODABPUZPVYDEF-CIBWSIAMSA-O,"InChI=1S/C53H58O30/c1-18-34(58)39(63)43(67)50(76-18)75-17-33-38(62)42(66)46(70)53(83-33)80-30-14-25-26(55)12-24(13-29(25)79-47(30)21-10-27(56)35(59)28(57)11-21)78-52-45(69)41(65)37(61)32(82-52)16-74-49(72)20-4-8-23(9-5-20)77-51-44(68)40(64)36(60)31(81-51)15-73-48(71)19-2-6-22(54)7-3-19/h2-14,18,31-34,36-46,50-53,58,60-70H,15-17H2,1H3,(H4-,54,55,56,57,59,71)/p+1/t18-,31+,32+,33+,34-,36+,37+,38+,39+,40-,41-,42-,43+,44+,45+,46+,50+,51+,52+,53+/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c(O)cc(=[O+][C@@H]5O[C@H](COC(=O)c6ccc(O[C@@H]7O[C@H](COC(O)=C8C=CC(=O)C=C8)[C@@H](O)[C@H](O)[C@H]7O)cc6)[C@@H](O)[C@H](O)[C@H]5O)cc-4oc3-c3cc(O)c(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C53H59O30+,pos_2_2proton1ammonium,1175.30856690809,YODABPUZPVYDEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Aconitum fischeri,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,2,7.0 4815,3862,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.39556432,ISDB,,,,,,,BKPBDNJGYXIRBK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5822572708129883 4816,3854,86,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.83191943,ISDB,WHFHDVDXYKOSKI-UHFFFAOYSA-N,"InChI=1S/C10H12/c1-3-9-5-7-10(4-2)8-6-9/h3,5-8H,1,4H2,2H3",C=Cc1ccc(CC)cc1,C10H12,,132.093900384,WHFHDVDXYKOSKI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Magnolia kobus,664531.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Magnoliaceae'],['Unknown'],['Magnolia'],['Magnolia kobus'],4,3,8.827677726745605 4817,3851,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_2MHNH3,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],9,0,9.0 4818,3849,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.21719141,ISDB,DEUAMKIXCAXPMV-UHFFFAOYSA-N,"InChI=1S/C24H38N2O4/c1-6-23(4)11-9-17-16(15-23)7-8-18-22(2,3)19(10-12-24(17,18)5)30-21(29)26-20(28)25-13-14-27/h6,9,16,18-19,27H,1,7-8,10-15H2,2-5H3,(H2,25,26,28,29)",C=CC1(C)CC=C2C(CCC3C2(C)CCC(OC(=O)NC(=O)NCCO)C3(C)C)C1,C24H38N2O4,,418.283157696,DEUAMKIXCAXPMV,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Streptomyces albidoflavus,772836.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Streptomyces albidoflavus'],0,1,1.368765652179718 4819,3849,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.21719141,ISDB,DEUAMKIXCAXPMV-LQBJFXQCSA-N,"InChI=1S/C24H38N2O4/c1-6-23(4)11-9-17-16(15-23)7-8-18-22(2,3)19(10-12-24(17,18)5)30-21(29)26-20(28)25-13-14-27/h6,9,16,18-19,27H,1,7-8,10-15H2,2-5H3,(H2,25,26,28,29)/t16-,18+,19+,23-,24-/m0/s1",C=C[C@@]1(C)CC=C2[C@@H](CC[C@@H]3C(C)(C)[C@H](OC(=O)NC(=O)NCCO)CC[C@@]23C)C1,C24H38N2O4,,418.283157696,DEUAMKIXCAXPMV,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,1,1.368765652179718 4820,3843,-1,,,,0.21683979,ISDB,ROIDNUNHRGMTMG-SAMRHTEJSA-N,"InChI=1S/C27H33NO5/c1-23(2,30)22-19(29)14-20-26(31)10-9-15-13-17-16-7-5-6-8-18(16)28-21(17)25(15,4)24(26,3)11-12-27(20,32)33-22/h5-8,14-15,22,28,30-32H,9-13H2,1-4H3/t15-,22-,24+,25+,26+,27-/m0/s1",CC(C)(O)[C@H]1O[C@@]2(O)CC[C@@]3(C)[C@@](O)(CC[C@H]4Cc5c([nH]c6ccccc56)[C@@]43C)C2=CC1=O,C27H33NO5,,451.235873156,ROIDNUNHRGMTMG,Alkaloids,Tryptophan alkaloids,Indole-Diterpenoid alkaloids (Penitrems),Penicillium paxilli,937350.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium paxilli'],1,0,1.8673591613769531 4821,3840,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.87334603,ISDB,MDAXYSXRAMOWLY-UHFFFAOYSA-N,"InChI=1S/C12H16/c1-9-7-10(2)12-6-4-3-5-11(12)8-9/h7-8H,3-6H2,1-2H3",Cc1cc(C)c2c(c1)CCCC2,C12H16,,160.125200512,MDAXYSXRAMOWLY,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,3,8.99338412284851 4822,3838,82,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1proton,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 4823,3837,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BCPJJFPKMVYIOS-HWKANZROSA-N,"InChI=1S/C12H12O6/c1-17-10-4-2-8(6-9(10)13)3-5-12(16)18-7-11(14)15/h2-6,13H,7H2,1H3,(H,14,15)/b5-3+",COc1ccc(/C=C/C(=O)OCC(=O)O)cc1O,C12H12O6,pos_1_1proton1methanol,252.063388104,BCPJJFPKMVYIOS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 4824,3837,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BCPJJFPKMVYIOS-HWKANZROSA-N,"InChI=1S/C12H12O6/c1-17-10-4-2-8(6-9(10)13)3-5-12(16)18-7-11(14)15/h2-6,13H,7H2,1H3,(H,14,15)/b5-3+",COc1ccc(/C=C/C(=O)OCC(=O)O)cc1O,C12H12O6,pos_1_1proton1methanol,252.063388104,BCPJJFPKMVYIOS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 4825,3836,698,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.25085425,ISDB,SBMFUYVWTXYRCJ-WQANCUIESA-N,"InChI=1S/C30H50O4/c1-18(2)7-8-20(32)19(3)25-21(33)15-28(6)23-10-9-22-26(4,17-31)24(34)11-12-29(22)16-30(23,29)14-13-27(25,28)5/h7,19-25,31-34H,8-17H2,1-6H3/t19-,20+,21+,22+,23+,24+,25+,26+,27-,28+,29-,30+/m1/s1",CC(C)=CC[C@H](O)[C@@H](C)[C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4[C@](C)(CO)[C@@H](O)CC[C@@]45C[C@@]35CC[C@]12C,C30H50O4,,474.37091008,SBMFUYVWTXYRCJ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,8.503417015075684 4826,3829,-1,,,,0.0,MS1_match,RJYIKDUVSPCWEE-UHFFFAOYSA-N,"InChI=1S/C9H8O7/c1-14-9(13)3-4(10)6(12)8-7(5(3)11)15-2-16-8/h10-12H,2H2,1H3",COC(=O)c1c(O)c(O)c2c(c1O)OCO2,C9H8O7,pos_1_1proton1ammonium,228.027002596,RJYIKDUVSPCWEE,Polyketides,,,Delphinium venulosum,885408.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium venulosum'],6,0,6.0 4827,3828,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.24102087,ISDB,DVNMUVHPUGDIPW-AAYWPADASA-N,"InChI=1S/C26H30O10/c1-11-26(30)25(20(29)31-6)17-18(33-11)34-19(28)22(17,4)9-14-23(25,5)15(35-26)7-12-13(24(14)10-32-24)8-16(27)36-21(12,2)3/h7-8,11,14-15,17-18,30H,9-10H2,1-6H3/t11-,14-,15+,17-,18-,22-,23-,24+,25+,26-/m0/s1",COC(=O)[C@]12[C@H]3[C@@H]4OC(=O)[C@@]3(C)C[C@H]3[C@@]1(C)[C@@H](C=C1C(=CC(=O)OC1(C)C)[C@]31CO1)O[C@@]2(O)[C@H](C)O4,C26H30O10,,502.1838971599998,DVNMUVHPUGDIPW,Polyketides,Meroterpenoids,Tetraketide meroterpenoids,Penicillium purpurogenum,5310739.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium purpurogenum'],1,0,1.96408349275589 4828,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 4829,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4830,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4831,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 4832,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 4833,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 4834,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 4835,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 4836,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 4837,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 4838,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 4839,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4840,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 4841,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 4842,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MHNH3,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4843,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MHNH3,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4844,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 4845,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 4846,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MHNH3,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 4847,3826,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_2MHNH3,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 4848,3824,-1,,,,0.0,MS1_match,KRDPVQAMMPYQFZ-UGZFTLGKSA-N,"InChI=1S/C59H94O27/c1-24-34(64)46(84-49-43(73)40(70)37(67)29(20-61)81-49)45(75)51(79-24)85-47-35(65)27(63)21-77-52(47)83-33-11-12-55(4)31(56(33,5)23-62)10-13-58(7)32(55)9-8-25-26-18-54(2,3)14-16-59(26,17-15-57(25,58)6)53(76)86-50-44(74)41(71)38(68)30(82-50)22-78-48-42(72)39(69)36(66)28(19-60)80-48/h8,23-24,26-52,60-61,63-75H,9-22H2,1-7H3/t24-,26-,27-,28+,29+,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,43+,44+,45+,46+,47+,48+,49-,50-,51-,52-,55-,56-,57+,58+,59-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)CC[C@@]6(C)[C@]5(C)CC[C@H]4[C@]3(C)C=O)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,C59H94O27,pos_3_1proton2sodium,1234.598247748,KRDPVQAMMPYQFZ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Nigella damascena,387814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella damascena'],6,0,6.0 4849,3822,-1,,,,0.0,MS1_match,NKFZLEYLWAFYEH-NSSLBSGISA-N,"InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15+,17-,18-,20-,21+,24+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,pos_2_2proton,596.1377348159999,NKFZLEYLWAFYEH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,0,6.0 4850,3822,-1,,,,0.0,MS1_match,NKFZLEYLWAFYEH-NSSLBSGISA-N,"InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15+,17-,18-,20-,21+,24+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,pos_2_2proton,596.1377348159999,NKFZLEYLWAFYEH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Helleborus viridis,948053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus viridis'],6,0,6.0 4851,3820,-1,,,,0.0,MS1_match,HFPZCAJZSCWRBC-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3",Cc1ccc(C(C)C)cc1,C10H14,pos_1_1proton,134.109550448,HFPZCAJZSCWRBC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 4852,3819,-1,,,,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton1ammonium,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 4853,3819,-1,,,,0.0,MS1_match,QAIPRVGONGVQAS-UHFFFAOYSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)",O=C(O)C=Cc1ccc(O)c(O)c1,C9H8O4,pos_1_1proton1ammonium,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 4854,3819,-1,,,,0.0,MS1_match,KKADPXVIOXHVKN-UHFFFAOYSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,10H,5H2,(H,12,13)",O=C(O)C(=O)Cc1ccc(O)cc1,C9H8O4,pos_1_1proton1ammonium,180.042258736,KKADPXVIOXHVKN,Shikimates and Phenylpropanoids,,,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,0,8.0 4855,3817,678,Alkaloids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,PULWZCUZNRVAHT-VBUZYTKISA-N,"InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16?,17-,18+,19-,20?,21+,22-,23-,24+,25-,26+,28+,29?,30+,31-/m1/s1",COC[C@]12CN(C)[C@@H]3C4[C@H](OC)[C@H]1[C@]3(C1CC3(O)[C@H](OC(=O)c5ccccc5)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]3OC)[C@@H](OC)C[C@H]2O,C31H43NO10,pos_1_sodium,589.288696576,PULWZCUZNRVAHT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,3,7.5 4856,3817,678,Alkaloids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,PULWZCUZNRVAHT-VBUZYTKISA-N,"InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16?,17-,18+,19-,20?,21+,22-,23-,24+,25-,26+,28+,29?,30+,31-/m1/s1",COC[C@]12CN(C)[C@@H]3C4[C@H](OC)[C@H]1[C@]3(C1CC3(O)[C@H](OC(=O)c5ccccc5)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]3OC)[C@@H](OC)C[C@H]2O,C31H43NO10,pos_1_sodium,589.288696576,PULWZCUZNRVAHT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,3,7.5 4857,3817,678,Alkaloids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,PULWZCUZNRVAHT-VBUZYTKISA-N,"InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16?,17-,18+,19-,20?,21+,22-,23-,24+,25-,26+,28+,29?,30+,31-/m1/s1",COC[C@]12CN(C)[C@@H]3C4[C@H](OC)[C@H]1[C@]3(C1CC3(O)[C@H](OC(=O)c5ccccc5)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]3OC)[C@@H](OC)C[C@H]2O,C31H43NO10,pos_1_sodium,589.288696576,PULWZCUZNRVAHT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 4858,3817,678,Alkaloids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,YTEHIGWZSLFXJT-BHESEAIESA-N,"InChI=1S/C31H43NO10/c1-5-32-14-27(15-39-2)20(33)10-22(41-4)31-18-11-29(37)21(34)13-28(36,19(24(31)32)12-30(27,31)38)23(18)25(29)42-26(35)16-6-8-17(40-3)9-7-16/h6-9,18-25,33-34,36-38H,5,10-15H2,1-4H3/t18-,19-,20+,21-,22-,23-,24+,25+,27-,28+,29+,30-,31+/m0/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@H]5C[C@]6(O)[C@H](OC(=O)c7ccc(OC)cc7)[C@H]5[C@@](O)(C[C@@H]6O)[C@@H](C[C@]23O)[C@@H]14,C31H43NO10,pos_1_sodium,589.288696576,YTEHIGWZSLFXJT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 4859,3816,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.69503975,ISDB,POIARNZEYGURDG-FNORWQNLSA-N,"InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8H,9H2,1-4H3/b7-5+",C/C=C/C(=O)C1=C(C)C=CCC1(C)C,C13H18O,,190.135765196,POIARNZEYGURDG,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Viburnum orientale,296902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum orientale'],5,1,8.280158996582031 4860,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 4861,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],8,0,8.0 4862,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 4863,3815,-1,,,,0.0,MS1_match,JLUQTCXCAFSSLD-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c11-7-1-3-9(13-7)5-6-10(9)4-2-8(12)14-10/h1-4H,5-6H2",O=C1C=CC2(CCC23C=CC(=O)O3)O1,C10H8O4,pos_2_2proton2acetonitrile,192.042258736,JLUQTCXCAFSSLD,Shikimates and Phenylpropanoids,,,Clematis hirsutissima,3945124.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hirsutissima'],8,0,8.0 4864,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis pubescens,446571.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis pubescens'],8,0,8.0 4865,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis microphylla,32689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis microphylla'],8,0,8.0 4866,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis flammula,3945102.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis flammula'],8,0,8.0 4867,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis glycinoides,842003.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis glycinoides'],8,0,8.0 4868,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis gentianoides,72780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis gentianoides'],8,0,8.0 4869,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis fawcettii,5737776.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis fawcettii'],8,0,8.0 4870,3815,-1,,,,0.0,MS1_match,RNYZJZKPGHQTJR-UHFFFAOYSA-N,"InChI=1S/C5H4O2/c1-4-2-3-5(6)7-4/h2-3H,1H2",C=C1C=CC(=O)O1,C5H4O2,pos_1_1proton1acetonitrile,96.021129368,RNYZJZKPGHQTJR,Shikimates and Phenylpropanoids,,,Clematis aristata,5737721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis aristata'],8,0,8.0 4871,3814,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 4872,3814,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1proton,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 4873,3809,-1,,,,0.0,MS1_match,JIHQLTXNRUMMRM-IYTWNDGFSA-N,"InChI=1S/C18H32O8/c19-11-13-15(21)16(22)17(23)18(26-13)24-10-6-4-2-1-3-5-7-12-8-9-14(20)25-12/h12-13,15-19,21-23H,1-11H2/t12-,13-,15-,16+,17-,18-/m1/s1",O=C1CC[C@@H](CCCCCCCCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C18H32O8,pos_1_1proton1ammonium,376.2097179839999,JIHQLTXNRUMMRM,Fatty acids,Fatty esters,Lactones,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 4874,3807,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.3747279,ISDB,WPEKKKYUGODPOL-JMRWPWSNSA-N,"InChI=1S/C43H66O10/c1-13-25(5)35(45)38(47)52-30-22-42(10)29(27-20-28(51-23-27)19-24(3)4)15-16-31(42)43(11)33(53-39(48)36(46)26(6)14-2)21-32(40(7,8)49)41(9,37(30)43)18-17-34(44)50-12/h13-14,16,19,27-30,32-33,35-37,45-46,49H,15,17-18,20-23H2,1-12H3/b25-13+,26-14+/t27-,28-,29+,30-,32+,33-,35-,36-,37-,41+,42+,43-/m1/s1",C/C=C(\C)[C@@H](O)C(=O)O[C@@H]1C[C@]2(C)C(=CC[C@H]2[C@H]2CO[C@H](C=C(C)C)C2)[C@@]2(C)[C@H]1[C@@](C)(CCC(=O)OC)[C@H](C(C)(C)O)C[C@H]2OC(=O)[C@H](O)/C(C)=C/C,C43H66O10,,742.465598312,WPEKKKYUGODPOL,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Aglaia argentea,627552.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Aglaia'],['Aglaia argentea'],4,2,6.498911619186401 4875,3806,-1,,,,0.0,MS1_match,OGOVVRHSMHRFIK-MYEWIJLCSA-N,"InChI=1S/C22H22O12/c1-32-15-8-11(9-16(33-2)18(15)26)4-6-17(25)34-19(20(27)28)22(31,21(29)30)10-12-3-5-13(23)14(24)7-12/h3-9,19,23-24,26,31H,10H2,1-2H3,(H,27,28)(H,29,30)/b6-4+/t19-,22-/m1/s1",COc1cc(/C=C/C(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc(OC)c1O,C22H22O12,pos_1_1proton1acetonitrile,478.1111261439999,OGOVVRHSMHRFIK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 4876,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_2MNa,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,0,6.0 4877,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_2MNa,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 4878,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_2MNa,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 4879,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CUFLZUDASVUNOE-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,9-10H,1H3",COC(=O)c1ccc(O)c(O)c1,C8H8O4,pos_2MNa,168.042258736,CUFLZUDASVUNOE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Delphinium venulosum,885408.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium venulosum'],6,0,6.0 4880,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,OLBNOBQOQZRLMP-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-11-6-3-5(9)4-7(12-2)8(6)10/h3-4H,1-2H3",COC1=CC(=O)C=C(OC)C1=O,C8H8O4,pos_2MNa,168.042258736,OLBNOBQOQZRLMP,Polyketides,Aromatic polyketides,Benzoquinones,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 4881,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MRIXVKKOHPQOFK-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4,9H,1H3,(H,10,11)",COc1ccc(C(=O)O)c(O)c1,C8H8O4,pos_2MNa,168.042258736,MRIXVKKOHPQOFK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 4882,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,VXWUBYBAUIHOHG-DTLFHODZSA-N,"InChI=1S/C8H8O4/c9-5-2-1-4-3-6(10)12-8(4)7(5)11/h1-3,5,7-9,11H/t5-,7+,8+/m1/s1",O=C1C=C2C=C[C@@H](O)[C@H](O)[C@H]2O1,C8H8O4,pos_2MNa,168.042258736,VXWUBYBAUIHOHG,,,,Semiaquilegia adoxoides,781970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Semiaquilegia'],['Semiaquilegia adoxoides'],6,0,6.0 4883,3799,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,IZZIWIAOVZOBLF-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11)",COc1ccc(O)c(C(=O)O)c1,C8H8O4,pos_2MNa,168.042258736,IZZIWIAOVZOBLF,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Thalictrum fargesii,124386.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fargesii'],6,0,6.0 4884,3798,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1proton1ammonium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 4885,3798,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1proton1ammonium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 4886,3796,1143,Terpenoids,,,0.0,MS1_match,YFWQVKBPDWOEPV-SRXUNSAMSA-N,"InChI=1S/C28H34O7/c1-13-10-17-26(3,23(33)21(13)31)7-9-28(5)18-12-15(29)19-14(25(18,2)6-8-27(17,28)4)11-16(30)22(32)20(19)24(34)35/h11-13,17,23,30,32-33H,6-10H2,1-5H3,(H,34,35)/t13-,17-,23-,25+,26-,27+,28-/m1/s1",C[C@@H]1C[C@@H]2[C@@](C)(CC[C@]3(C)C4=CC(=O)c5c(cc(O)c(O)c5C(=O)O)[C@]4(C)CC[C@@]23C)[C@H](O)C1=O,C28H34O7,pos_1_sodium,482.230453428,YFWQVKBPDWOEPV,Terpenoids,,,Monteverdia macrocarpa,7631453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia macrocarpa'],6,1,6.5 4887,3794,-1,,,,0.0,MS1_match,DFNZYFAJQPLJFI-UHFFFAOYSA-N,"InChI=1S/C10H9NO2/c1-2-7-5-11-6-9-8(7)3-4-13-10(9)12/h2,5-6H,1,3-4H2",C=Cc1cncc2c1CCOC2=O,C10H9NO2,pos_2MCH3CNNa,175.063328528,DFNZYFAJQPLJFI,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Dipsacus azureus,6061231.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus azureus'],6,0,6.0 4888,3794,-1,,,,0.0,MS1_match,DFNZYFAJQPLJFI-UHFFFAOYSA-N,"InChI=1S/C10H9NO2/c1-2-7-5-11-6-9-8(7)3-4-13-10(9)12/h2,5-6H,1,3-4H2",C=Cc1cncc2c1CCOC2=O,C10H9NO2,pos_2MCH3CNNa,175.063328528,DFNZYFAJQPLJFI,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Dipsacus dipsacoides,6061231.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus azureus'],6,0,6.0 4889,3794,-1,,,,0.0,MS1_match,DFNZYFAJQPLJFI-UHFFFAOYSA-N,"InChI=1S/C10H9NO2/c1-2-7-5-11-6-9-8(7)3-4-13-10(9)12/h2,5-6H,1,3-4H2",C=Cc1cncc2c1CCOC2=O,C10H9NO2,pos_2MCH3CNNa,175.063328528,DFNZYFAJQPLJFI,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4890,3794,-1,,,,0.0,MS1_match,DFNZYFAJQPLJFI-UHFFFAOYSA-N,"InChI=1S/C10H9NO2/c1-2-7-5-11-6-9-8(7)3-4-13-10(9)12/h2,5-6H,1,3-4H2",C=Cc1cncc2c1CCOC2=O,C10H9NO2,pos_2MCH3CNNa,175.063328528,DFNZYFAJQPLJFI,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 4891,3794,-1,,,,0.0,MS1_match,DFNZYFAJQPLJFI-UHFFFAOYSA-N,"InChI=1S/C10H9NO2/c1-2-7-5-11-6-9-8(7)3-4-13-10(9)12/h2,5-6H,1,3-4H2",C=Cc1cncc2c1CCOC2=O,C10H9NO2,pos_2MCH3CNNa,175.063328528,DFNZYFAJQPLJFI,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4892,3787,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.8484597,ISDB,OIIJXQMSEYQDDI-UHFFFAOYSA-N,"InChI=1S/C13H18/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h7-8,10H,4-6H2,1-3H3",Cc1ccc(C)c2c1CCCC2C,C13H18,,174.140850576,OIIJXQMSEYQDDI,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.893838882446289 4893,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 4894,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 4895,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 4896,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 4897,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4898,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4899,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 4900,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 4901,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 4902,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 4903,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum podocarpum,119512.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum podocarpum'],6,0,6.0 4904,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 4905,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 4906,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 4907,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 4908,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4909,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 4910,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 4911,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 4912,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 4913,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 4914,3781,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Thalictrum podocarpum,119512.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum podocarpum'],6,0,6.0 4915,3781,-1,,,,0.0,MS1_match,DKXNBNKWCZZMJT-JUUDDBOJSA-N,"InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h1,4-12,14-21H,2-3H2/t4-,5+,6+,7+,8+,9-,10+,11-,12+/m0/s1",O=C[C@H](O)[C@@H](O)[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C12H22O11,pos_1_1proton1ammonium,342.116211524,DKXNBNKWCZZMJT,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 4916,3781,-1,,,,0.0,MS1_match,DKXNBNKWCZZMJT-JUUDDBOJSA-N,"InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h1,4-12,14-21H,2-3H2/t4-,5+,6+,7+,8+,9-,10+,11-,12+/m0/s1",O=C[C@H](O)[C@@H](O)[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C12H22O11,pos_1_1proton1ammonium,342.116211524,DKXNBNKWCZZMJT,Carbohydrates,Saccharides,Disaccharides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 4917,3778,514,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,3,8.5 4918,3778,514,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,3,8.5 4919,3774,-1,,,,0.0,MS1_match,KRKNYBCHXYNGOX-UHFFFAOYSA-N,"InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)",O=C(O)CC(O)(CC(=O)O)C(=O)O,C6H8O7,pos_1_1proton1ammonium,192.027002596,KRKNYBCHXYNGOX,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 4920,3772,1048,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.25010058,ISDB,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,8.500402331352234 4921,3772,1048,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.25010058,ISDB,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,8.500402331352234 4922,3772,1048,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.25010058,ISDB,QBXRXORKIXERDE-JJPYBHRJSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24+,25+,28+,29+,30+,32-,33-,34-,35+,38-,39-,40+,41-,42-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O[C@@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,8.500402331352234 4923,3772,1048,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.25010058,ISDB,QBXRXORKIXERDE-QLYLRAMCSA-N,"InChI=1S/C42H46O25/c43-11-23-28(52)32(56)35(59)40(62-23)60-16-9-21(50)27-22(10-16)61-36(15-3-5-18(47)20(49)8-15)37(31(27)55)66-42-39(34(58)30(54)25(13-45)64-42)67-41-38(33(57)29(53)24(12-44)63-41)65-26(51)6-2-14-1-4-17(46)19(48)7-14/h1-10,23-25,28-30,32-35,38-50,52-54,56-59H,11-13H2/b6-2+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40-,41+,42+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C42H46O25,,950.232816972,QBXRXORKIXERDE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,8.500402331352234 4924,3770,237,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,VMAPCZGMIAGZBE-MVNJUIESSA-N,"InChI=1S/C38H38O19/c1-16(2)48-28-13-25(49-18(4)40)14-29-31(28)32(46)35(33(55-29)24-10-11-26(50-19(5)41)27(12-24)51-20(6)42)57-38-37(54-23(9)45)36(53-22(8)44)34(52-21(7)43)30(56-38)15-47-17(3)39/h10-14,30,34,36-38H,1,15H2,2-9H3/t30-,34+,36+,37-,38+/m1/s1",C=C(C)Oc1cc(OC(C)=O)cc2oc(-c3ccc(OC(C)=O)c(OC(C)=O)c3)c(O[C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)c(=O)c12,C38H38O19,pos_2_1proton1sodium,798.200728996,VMAPCZGMIAGZBE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,3,7.5 4925,3764,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.68610835,ISDB,FIZZAWTVIDYQPI-TUAOUCFPSA-N,"InChI=1S/C12H18O/c1-9-5-3-4-6-11-10(9)7-8-12(11,2)13/h4,6,10-11,13H,1,3,5,7-8H2,2H3/t10-,11+,12-/m0/s1",C=C1CCC=C[C@@H]2[C@H]1CC[C@]2(C)O,C12H18O,,178.135765196,FIZZAWTVIDYQPI,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Dictamnus dasycarpus,651514.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Dictamnus'],['Dictamnus dasycarpus'],4,2,7.744433403015137 4926,3761,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.4249283,ISDB,SZNQPFAEOXCITM-PWBFPFQSSA-N,"InChI=1S/C12H22O3/c1-5-10(9(2)3)6-7-12(4,15)8-11(13)14/h6-7,9-10,15H,5,8H2,1-4H3,(H,13,14)/b7-6+/t10-,12-/m1/s1",CC[C@H](/C=C/[C@@](C)(O)CC(=O)O)C(C)C,C12H22O3,,214.156894564,SZNQPFAEOXCITM,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,5.699713230133057 4927,3760,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1potassium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 4928,3758,476,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1proton1ammonium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 4929,3757,1657,Terpenoids,Apocarotenoids,Megastigmanes,0.48177868,ISDB,NVFMDEVKKYQMLD-NBVSPMLASA-N,"InChI=1S/C19H30O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h11-12,14-18,20-24H,7-9H2,1-4H3/t11-,12-,14+,15+,16-,17+,18+/m0/s1",CC1=C(C#C[C@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)C[C@@H](O)C1,C19H30O7,,370.1991533,NVFMDEVKKYQMLD,Terpenoids,Apocarotenoids,Megastigmanes,Rosa gallica,333878.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa gallica'],4,3,7.427114725112915 4930,3757,1657,Terpenoids,Apocarotenoids,Megastigmanes,0.48177868,ISDB,NVFMDEVKKYQMLD-NBVSPMLASA-N,"InChI=1S/C19H30O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h11-12,14-18,20-24H,7-9H2,1-4H3/t11-,12-,14+,15+,16-,17+,18+/m0/s1",CC1=C(C#C[C@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)C[C@@H](O)C1,C19H30O7,,370.1991533,NVFMDEVKKYQMLD,Terpenoids,Apocarotenoids,Megastigmanes,Rosa damascena,5146739.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa x damascena'],4,3,7.427114725112915 4931,3753,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.62086344,ISDB,CZYPGTRKJFYXLT-SUHXYMONSA-N,"InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h7,11,13-17,20,22-25H,5-6,8-9H2,1-4H3/t11-,13-,14-,15+,16-,17-,19-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)CC[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H32O8,,388.2097179839999,CZYPGTRKJFYXLT,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Epimedium grandiflorum,655264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium grandiflorum'],5,3,8.983453750610352 4932,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-UHFFFAOYSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3",Cc1occc(=O)c1OC1OC(CO)C(O)C(O)C1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Gamblea innovans,709202.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Gamblea'],['Gamblea innovans'],4,0,7.6722118854522705 4933,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,0,7.6722118854522705 4934,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Chaerophyllum hirsutum,815187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Chaerophyllum'],['Chaerophyllum hirsutum'],4,0,7.6722118854522705 4935,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Aeschynanthus bracteatus,154188.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Gesneriaceae'],['Trichosporeae'],['Aeschynanthus'],['Aeschynanthus bracteatus'],4,0,7.6722118854522705 4936,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Turnera diffusa,92073.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Turnera'],['Turnera diffusa'],4,0,7.6722118854522705 4937,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Inulanthera nuda,7596867.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Inulanthera'],['Inulanthera nuda'],4,0,7.6722118854522705 4938,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Prangos uloptera,413490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Unknown'],['Prangos'],['Prangos uloptera'],4,0,7.6722118854522705 4939,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Prangos tschimganica,3888519.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Unknown'],['Prangos'],['Prangos tschimganica'],4,0,7.6722118854522705 4940,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Petrorhagia prolifera,312857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Petrorhagia'],['Petrorhagia prolifera'],4,0,7.6722118854522705 4941,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Petrorhagia nanteuilii,5143926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Petrorhagia'],['Petrorhagia nanteuilii'],4,0,7.6722118854522705 4942,3751,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.918053,ISDB,YGSIRXHFAUFUEJ-GPTQDWHKSA-N,"InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C12H16O8,,288.084517472,YGSIRXHFAUFUEJ,Polyketides,Cyclic polyketides,4-pyrone derivatives,Helichrysum italicum,54015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Helichrysum'],['Helichrysum italicum'],4,0,7.6722118854522705 4943,3750,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_sodium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 4944,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Morus indica,307703.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus indica'],4,3,9.177737712860107 4945,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Donax grandis,228549.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Marantaceae'],['Unknown'],['Donax'],['Donax grandis'],4,3,9.177737712860107 4946,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Gloriosa superba,82472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Colchicaceae'],['Unknown'],['Gloriosa'],['Gloriosa superba'],4,3,9.177737712860107 4947,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Dendrobium crumenatum,1008721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Malaxideae'],['Dendrobium'],['Dendrobium crumenatum'],4,3,9.177737712860107 4948,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Eichhornia crassipes,149965.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Commelinales'],['Pontederiaceae'],['Unknown'],['Eichhornia'],['Eichhornia crassipes'],4,3,9.177737712860107 4949,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Archontophoenix alexandrae,470310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Arecales'],['Arecaceae'],['Areceae'],['Archontophoenix'],['Archontophoenix alexandrae'],4,3,9.177737712860107 4950,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Sagittaria sagittifolia,481954.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Alismataceae'],['Unknown'],['Sagittaria'],['Sagittaria sagittifolia'],4,3,9.177737712860107 4951,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Areca catechu,180819.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Arecales'],['Arecaceae'],['Areceae'],['Areca'],['Areca catechu'],4,3,9.177737712860107 4952,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Epipremnum pinnatum,473049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Araceae'],['Monstereae'],['Epipremnum'],['Epipremnum pinnatum'],4,3,9.177737712860107 4953,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Oncidium,137617.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Cymbidieae'],['Oncidium'],['Unknown'],4,3,9.177737712860107 4954,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Alpinia galanga,1063872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Alpinia'],['Alpinia galanga'],4,3,9.177737712860107 4955,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Musa cavendishii,207474.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Musaceae'],['Unknown'],['Musa'],['Musa acuminata'],4,3,9.177737712860107 4956,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Cyperus aromaticus,3959943.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Cyperaceae'],['Cypereae'],['Cyperus'],['Cyperus aromaticus'],4,3,9.177737712860107 4957,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Cocos nucifera,366250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Arecales'],['Arecaceae'],['Cocoseae'],['Cocos'],['Cocos nucifera'],4,3,9.177737712860107 4958,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Tacca cristata,1050076.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dioscoreales'],['Taccaceae'],['Unknown'],['Tacca'],['Tacca integrifolia'],4,3,9.177737712860107 4959,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Tacca integrifolia,1050076.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dioscoreales'],['Taccaceae'],['Unknown'],['Tacca'],['Tacca integrifolia'],4,3,9.177737712860107 4960,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Pandanus odorifer,266217.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Pandanales'],['Pandanaceae'],['Unknown'],['Pandanus'],['Pandanus odorifer'],4,3,9.177737712860107 4961,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Alpinia purpurata,573266.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Alpinia'],['Alpinia purpurata'],4,3,9.177737712860107 4962,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Hydrilla verticillata,332061.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Hydrocharitaceae'],['Unknown'],['Hydrilla'],['Hydrilla verticillata'],4,3,9.177737712860107 4963,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Datura stramonium,822825.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Datureae'],['Datura'],['Datura stramonium'],4,3,9.177737712860107 4964,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Morus bombycis,210686.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus bombycis'],4,3,9.177737712860107 4965,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Morus australis,210689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus australis'],4,3,9.177737712860107 4966,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Cajanus cajan,612448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Cajanus'],['Cajanus cajan'],4,3,9.177737712860107 4967,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,3,9.177737712860107 4968,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Indigofera hirsuta,1011944.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Indigofereae'],['Indigofera'],['Indigofera hirsuta'],4,3,9.177737712860107 4969,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Indigofera schimperi,306750.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Indigofereae'],['Indigofera'],['Indigofera schimperi'],4,3,9.177737712860107 4970,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Pisum sativum,359905.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Pisum'],['Pisum sativum'],4,3,9.177737712860107 4971,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Indigofera pilosa,3922867.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Indigofereae'],['Indigofera'],['Indigofera pilosa'],4,3,9.177737712860107 4972,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Calendula officinalis,768229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Calenduleae'],['Calendula'],['Calendula officinalis'],4,3,9.177737712860107 4973,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Telekia speciosa,959562.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Telekia'],['Telekia speciosa'],4,3,9.177737712860107 4974,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Astragalus hamosus,626803.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Astragalus'],['Astragalus hamosus'],4,3,9.177737712860107 4975,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Jatropha gossypiifolia,610105.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Jatropheae'],['Jatropha'],['Jatropha gossypiifolia'],4,3,9.177737712860107 4976,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Citrus unshiu,1011450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus unshiu'],4,3,9.177737712860107 4977,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Eriobotrya japonica,207983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Eriobotrya'],['Eriobotrya japonica'],4,3,9.177737712860107 4978,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Prunus persica,259054.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus persica'],4,3,9.177737712860107 4979,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Citrus deliciosa,83847.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus deliciosa'],4,3,9.177737712860107 4980,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Citrus reticulata,37136.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus reticulata'],4,3,9.177737712860107 4981,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Malus pumila,854961.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Malus'],['Malus pumila'],4,3,9.177737712860107 4982,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Malus domestica,3902985.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Malus'],['Malus domestica'],4,3,9.177737712860107 4983,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Diospyros virginiana,525019.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ebenaceae'],['Unknown'],['Diospyros'],['Diospyros virginiana'],4,3,9.177737712860107 4984,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Stratiotes aloides,613170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Hydrocharitaceae'],['Unknown'],['Stratiotes'],['Stratiotes aloides'],4,3,9.177737712860107 4985,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Hydrocharis morsus-ranae,40106.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Hydrocharitaceae'],['Unknown'],['Hydrocharis'],['Hydrocharis morsus-ranae'],4,3,9.177737712860107 4986,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Stellaria media,432718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Alsineae'],['Stellaria'],['Stellaria media'],4,3,9.177737712860107 4987,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Pentaclethra macrophylla,788558.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Mimoseae'],['Pentaclethra'],['Pentaclethra macrophylla'],4,3,9.177737712860107 4988,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Treculia africana,1090387.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Treculia'],['Treculia africana'],4,3,9.177737712860107 4989,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Colchicum trigynum,685388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Colchicaceae'],['Unknown'],['Colchicum'],['Colchicum trigynum'],4,3,9.177737712860107 4990,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Spermacoce pusilla,3871913.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Spermacoce'],['Spermacoce pusilla'],4,3,9.177737712860107 4991,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Senna obtusifolia,335059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Senna'],['Senna obtusifolia'],4,3,9.177737712860107 4992,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Stachys officinalis,103745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Betonica'],['Betonica officinalis'],4,3,9.177737712860107 4993,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Beta vulgaris,273185.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Beta'],['Beta vulgaris'],4,3,9.177737712860107 4994,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Salvia hispanica,1025159.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia hispanica'],4,3,9.177737712860107 4995,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Trifolium pratense,839027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trifolium'],['Trifolium pratense'],4,3,9.177737712860107 4996,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Sida hermaphrodita,61566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Sida'],['Sida hermaphrodita'],4,3,9.177737712860107 4997,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Trifolium repens,116218.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trifolium'],['Trifolium repens'],4,3,9.177737712860107 4998,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Canavalia ensiformis,612442.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Canavalia'],['Canavalia ensiformis'],4,3,9.177737712860107 4999,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Cucurbita foetidissima,429694.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Cucurbiteae'],['Cucurbita'],['Cucurbita foetidissima'],4,3,9.177737712860107 5000,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,3,9.177737712860107 5001,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Medicago sativa,1086789.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Medicago'],['Medicago sativa'],4,3,9.177737712860107 5002,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Daucus carota,372836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Daucus'],['Daucus carota'],4,3,9.177737712860107 5003,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,3,9.177737712860107 5004,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Oryza sativa,709894.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Oryzeae'],['Oryza'],['Oryza sativa'],4,3,9.177737712860107 5005,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Lathyrus sativus,510046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Lathyrus'],['Lathyrus sativus'],4,3,9.177737712860107 5006,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Erythroxylum coca,57960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Erythroxylaceae'],['Unknown'],['Erythroxylum'],['Erythroxylum coca'],4,3,9.177737712860107 5007,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],4,3,9.177737712860107 5008,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Punica granatum,646814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Punica'],['Punica granatum'],4,3,9.177737712860107 5009,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-UHFFFAOYSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)",NC(N)=NCCCC(N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,9.177737712860107 5010,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Prunus domestica,731554.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus domestica'],4,3,9.177737712860107 5011,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Juncus effusus,26727.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Juncaceae'],['Unknown'],['Juncus'],['Juncus effusus'],4,3,9.177737712860107 5012,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Cannabis sativa,84004.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Cannabis'],['Cannabis sativa'],4,3,9.177737712860107 5013,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Thymus transcaucasicus,6084067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymus'],['Thymus transcaucasicus'],4,3,9.177737712860107 5014,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Prunus avium,162547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus avium'],4,3,9.177737712860107 5015,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Opuntia ficus-indica,396274.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Cactaceae'],['Unknown'],['Opuntia'],['Opuntia ficus-indica'],4,3,9.177737712860107 5016,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Helianthus annuus,515712.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Helianthus'],['Helianthus annuus'],4,3,9.177737712860107 5017,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Allium sativum,748370.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium sativum'],4,3,9.177737712860107 5018,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Castanea sativa,1028994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Castanea'],['Castanea sativa'],4,3,9.177737712860107 5019,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Psophocarpus tetragonolobus,116244.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Psophocarpus'],['Psophocarpus tetragonolobus'],4,3,9.177737712860107 5020,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-UHFFFAOYSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)",NC(N)=NCCCC(N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,3,9.177737712860107 5021,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,3,9.177737712860107 5022,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-UHFFFAOYSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)",NC(N)=NCCCC(N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,3,9.177737712860107 5023,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Catharanthus roseus,524094.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Vinceae'],['Catharanthus'],['Catharanthus roseus'],4,3,9.177737712860107 5024,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,3,9.177737712860107 5025,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Capsella bursa-pastoris,833644.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Capsella'],['Capsella bursa-pastoris'],4,3,9.177737712860107 5026,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Arnica montana,942734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Madieae'],['Arnica'],['Arnica montana'],4,3,9.177737712860107 5027,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Apium graveolens,2472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,3,9.177737712860107 5028,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-BYPYZUCNSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1",N=C(N)NCCC[C@H](N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Suaeda aegyptiaca,737778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Suaeda'],['Suaeda aegyptiaca'],4,3,9.177737712860107 5029,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-UHFFFAOYSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)",NC(N)=NCCCC(N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,9.177737712860107 5030,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-UHFFFAOYSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)",NC(N)=NCCCC(N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Pseudostellaria heterophylla,698777.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Alsineae'],['Pseudostellaria'],['Pseudostellaria heterophylla'],4,3,9.177737712860107 5031,3747,857,Amino acids and Peptides,Small peptides,Aminoacids,0.9194344,ISDB,ODKSFYDXXFIFQN-UHFFFAOYSA-N,"InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)",NC(N)=NCCCC(N)C(=O)O,C6H14N4O2,,174.111675688,ODKSFYDXXFIFQN,Amino acids and Peptides,Small peptides,Aminoacids,Hyacinthoides non-scripta,268365.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hyacinthaceae'],['Hyacintheae'],['Hyacinthoides'],['Hyacinthoides non-scripta'],4,3,9.177737712860107 5032,3746,-1,,,,0.0,MS1_match,ZUBPYPXGKGGDPG-CIWQMLCSSA-N,"InChI=1S/C64H104O30/c1-24-36(69)41(74)45(78)54(86-24)91-49-30(20-65)88-52(47(80)43(49)76)85-23-31-40(73)42(75)46(79)55(89-31)94-58(82)64-17-16-62(8)26(27(64)18-59(3,4)34(68)19-64)10-11-33-61(7)14-13-35(60(5,6)32(61)12-15-63(33,62)9)90-57-51(39(72)29(67)22-84-57)93-56-48(81)50(37(70)25(2)87-56)92-53-44(77)38(71)28(66)21-83-53/h10,24-25,27-57,65-81H,11-23H2,1-9H3/t24-,25-,27-,28+,29-,30+,31+,32-,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,61-,62+,63+,64+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@@]45CC[C@]6(C)C(=CC[C@@H]7[C@@]8(C)CC[C@H](O[C@@H]9OC[C@H](O)[C@H](O)[C@H]9O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O[C@@H]%10OC[C@@H](O)[C@@H](O)[C@H]%10O)[C@H]9O)C(C)(C)[C@@H]8CC[C@]76C)[C@@H]4CC(C)(C)[C@H](O)C5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241928,ZUBPYPXGKGGDPG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5033,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-UHFFFAOYSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3",CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(OC9OCC(O)C(O)C9O)C8O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C64H104O30,pos_3_2proton1sodium,1352.661241928,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5034,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 5035,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 5036,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis,964052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Unknown'],8,0,8.0 5037,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 5038,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 5039,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-UHFFFAOYSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3",CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(OC9OCC(O)C(O)C9O)C8O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C64H104O30,pos_3_2proton1sodium,1352.661241928,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5040,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 5041,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 5042,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis,964052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Unknown'],8,0,8.0 5043,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 5044,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 5045,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-UHFFFAOYSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3",CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(OC9OCC(O)C(O)C9O)C8O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,C64H104O30,pos_3_2proton1sodium,1352.661241928,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5046,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 5047,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 5048,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,0,8.0 5049,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis,964052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Unknown'],8,0,8.0 5050,3746,-1,,,,0.0,MS1_match,PLQZZVHULIUSEV-FXDKWXKUSA-N,"InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,60-,61-,62+,63+,64-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C64H104O30,pos_3_2proton1sodium,1352.661241927999,PLQZZVHULIUSEV,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 5051,3744,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YDDGKXBLOXEEMN-XAKUNQSDSA-N,"InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O,C22H18O12,pos_2MHNH3,474.0798260159999,YDDGKXBLOXEEMN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 5052,3744,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YDDGKXBLOXEEMN-XAKUNQSDSA-N,"InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O,C22H18O12,pos_2MHNH3,474.0798260159999,YDDGKXBLOXEEMN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 5053,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Morus indica,307703.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus indica'],4,3,8.378808975219727 5054,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UHFFFAOYSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2",OCC1NCC(O)C1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Adenophora triphylla,817781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Campanulaceae'],['Unknown'],['Adenophora'],['Adenophora triphylla'],4,3,8.378808975219727 5055,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Hyacinthoides non-scripta,268365.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hyacinthaceae'],['Hyacintheae'],['Hyacinthoides'],['Hyacinthoides non-scripta'],4,3,8.378808975219727 5056,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Hyacinthoides hispanica,652820.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Hyacinthaceae'],['Hyacintheae'],['Hyacinthoides'],['Hyacinthoides hispanica'],4,3,8.378808975219727 5057,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-MROZADKFSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4+,5-/m1/s1",OC[C@H]1NC[C@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Angylocalyx pynaertii,476511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Angylocalyceae'],['Angylocalyx'],['Angylocalyx pynaertii'],4,3,8.378808975219727 5058,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Angylocalyx boutiqueanus,3919913.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Angylocalyceae'],['Angylocalyx'],['Angylocalyx boutiqueanus'],4,3,8.378808975219727 5059,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,3,8.378808975219727 5060,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Adenophora triphylla var. japonica,526871.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Campanulaceae'],['Unknown'],['Adenophora'],['Adenophora triphylla'],4,3,8.378808975219727 5061,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Morus australis,210689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus australis'],4,3,8.378808975219727 5062,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UOWFLXDJSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/m1/s1",OC[C@H]1NC[C@@H](O)[C@@H]1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Morus bombycis,210686.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus bombycis'],4,3,8.378808975219727 5063,3741,938,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,0.71970224,ISDB,OQEBIHBLFRADNM-UHFFFAOYSA-N,"InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2",OCC1NCC(O)C1O,C5H11NO3,,133.073893212,OQEBIHBLFRADNM,Alkaloids,Ornithine alkaloids,Pyrrolidine alkaloids,Baphia nitida,351634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Baphieae'],['Baphia'],['Baphia nitida'],4,3,8.378808975219727 5064,3740,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],9,3,10.5 5065,3739,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,NMAOZVAEJYOPOF-SECBINFHSA-N,"InChI=1S/C10H12O5/c1-15-10(14)9(13)5-6-2-3-7(11)8(12)4-6/h2-4,9,11-13H,5H2,1H3/t9-/m1/s1",COC(=O)[C@H](O)Cc1ccc(O)c(O)c1,C10H12O5,pos_2MHNH3,212.068473484,NMAOZVAEJYOPOF,Shikimates and Phenylpropanoids,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 5066,3739,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,NMAOZVAEJYOPOF-SECBINFHSA-N,"InChI=1S/C10H12O5/c1-15-10(14)9(13)5-6-2-3-7(11)8(12)4-6/h2-4,9,11-13H,5H2,1H3/t9-/m1/s1",COC(=O)[C@H](O)Cc1ccc(O)c(O)c1,C10H12O5,pos_2MHNH3,212.068473484,NMAOZVAEJYOPOF,Shikimates and Phenylpropanoids,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 5067,3738,221,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.2147464,ISDB,SHOQQSABOUVQLJ-UHFFFAOYSA-N,"InChI=1S/C14H12O6/c1-16-11-7-4-5-19-8(7)6-9-10(11)12(17-2)13(18-3)14(15)20-9/h4-6H,1-3H3",COc1c(OC)c2c(OC)c3ccoc3cc2oc1=O,C14H12O6,,276.063388104,SHOQQSABOUVQLJ,Shikimates and Phenylpropanoids,Coumarins,Furocoumarins,Halfordia kendack,800699.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Halfordia'],['Halfordia kendack'],4,2,5.858985602855682 5068,3737,-1,,,,0.2920973,ISDB,QPGWFFXHPZTAJK-QHHZZUTCSA-N,"InChI=1S/C28H35NO3/c1-17-9-8-12-22-26(31)20(4)19(3)25-23(16-21-10-6-5-7-11-21)29-27(32)28(22,25)24(30)14-13-18(2)15-17/h5-8,10-14,17-19,22-23,25-26,31H,4,9,15-16H2,1-3H3,(H,29,32)/b12-8+,14-13+/t17-,18-,19+,22-,23-,25-,26+,28+/m1/s1",C=C1[C@H](C)[C@@H]2[C@@H](Cc3ccccc3)NC(=O)[C@@]23C(=O)/C=C/[C@@H](C)C[C@H](C)C/C=C/[C@@H]3[C@H]1O,C28H35NO3,,433.26169398,QPGWFFXHPZTAJK,Alkaloids,Pseudoalkaloids,Cytochalasan alkaloids,Daldinia,183725.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Xylariales'],['Xylariaceae'],['Unknown'],['Daldinia'],['Unknown'],1,0,2.1683892011642456 5069,3736,1480,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_sodium,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 5070,3736,1480,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_sodium,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 5071,3736,1480,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,VHHJRIJKJTYYIZ-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-10-14(4-3-9-27)5-7-16(18)36-20(12-28)22(30)15-6-8-17(19(11-15)35-2)37-26-25(33)24(32)23(31)21(13-29)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C26H36O12,pos_1_sodium,540.220676592,VHHJRIJKJTYYIZ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 5072,3736,1480,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,HZYWTYSKPVTFNA-URGBZLTBSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)30)25(38-26-24(33)23(32)22(31)20(12-28)37-26)21(13-29)36-17-8-5-14(4-3-9-27)10-19(17)35-2/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21+,22-,23+,24-,25+,26+/m1/s1",COc1cc([C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O,C26H36O12,pos_1_sodium,540.220676592,HZYWTYSKPVTFNA,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 5073,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5 5074,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5075,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 5076,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 5077,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5 5078,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5079,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5080,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 5081,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 5082,3735,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5083,3732,1300,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_sodium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 5084,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-SLHCBHIOSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10-/m0/s1",O=C(O)C[C@@H]1CCC(=O)[C@H]1C/C=C\CCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Salvia officinalis,820645.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia officinalis'],4,3,6.566785573959351 5085,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-BSANDHCLSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10-/m1/s1",O=C(O)C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Origanum dictamnus,479025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Origanum'],['Origanum dictamnus'],4,3,6.566785573959351 5086,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-SZXTZRQCSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10+/m1/s1",O=C(O)C[C@H]1CCC(=O)[C@H]1C/C=C\CCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,3,6.566785573959351 5087,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-UHFFFAOYSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)",O=C(O)CC1CCC(=O)C1CC=CCCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,6.566785573959351 5088,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-UHFFFAOYSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)",O=C(O)CC1CCC(=O)C1CC=CCCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Solanum demissum,66505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum demissum'],4,3,6.566785573959351 5089,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-BSANDHCLSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10-/m1/s1",O=C(O)C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Origanum vulgare,305918.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Origanum'],['Origanum vulgare'],4,3,6.566785573959351 5090,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-BSANDHCLSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10-/m1/s1",O=C(O)C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Samanea saman,930721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Samanea'],['Samanea saman'],4,3,6.566785573959351 5091,3731,564,Fatty acids,Octadecanoids,Jasmonic acids,0.2666964,ISDB,RZGFUGXQKMEMOO-BSANDHCLSA-N,"InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10-/m1/s1",O=C(O)C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO,C12H18O4,,226.120509056,RZGFUGXQKMEMOO,Fatty acids,Octadecanoids,Jasmonic acids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,6.566785573959351 5092,3730,61,Carbohydrates,Saccharides,Disaccharides,0.35147294,ISDB,JPLATTLXZFUKRQ-UVMZSPEXSA-N,"InChI=1S/C12H20O10/c13-1-4(15)10-11(5(16)3-20-10)22-12-9(19)8(18)7(17)6(2-14)21-12/h1,4-12,14-19H,2-3H2/t4-,5+,6+,7-,8-,9+,10+,11-,12-/m0/s1",O=C[C@H](O)[C@H]1OC[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C12H20O10,,324.10564684,JPLATTLXZFUKRQ,Carbohydrates,Saccharides,Disaccharides,Chondrus ocellatus,372375.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Chondrus'],['Chondrus ocellatus'],2,3,4.9058917760849 5093,3730,61,Carbohydrates,Saccharides,Disaccharides,0.35147294,ISDB,JPLATTLXZFUKRQ-AWXGPMDLSA-N,"InChI=1S/C12H20O10/c13-1-4(15)10-11(5(16)3-20-10)22-12-9(19)8(18)7(17)6(2-14)21-12/h1,4-12,14-19H,2-3H2/t4-,5+,6-,7+,8+,9-,10+,11-,12+/m1/s1",O=C[C@@H](O)[C@@H]1OC[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C12H20O10,,324.10564684,JPLATTLXZFUKRQ,Carbohydrates,Saccharides,Disaccharides,Gloiopeltis furcata,275661.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Gloiopeltis'],['Gloiopeltis furcata'],2,3,4.9058917760849 5094,3730,61,Carbohydrates,Saccharides,Disaccharides,0.35147294,ISDB,JPLATTLXZFUKRQ-UHFFFAOYSA-N,"InChI=1S/C12H20O10/c13-1-4(15)10-11(5(16)3-20-10)22-12-9(19)8(18)7(17)6(2-14)21-12/h1,4-12,14-19H,2-3H2",O=CC(O)C1OCC(O)C1OC1OC(CO)C(O)C(O)C1O,C12H20O10,,324.10564684,JPLATTLXZFUKRQ,Carbohydrates,Saccharides,Disaccharides,Pterocladiella tenuis,182322.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Florideophycidae'],['Unknown'],['Unknown'],['Unknown'],['Pterocladiella'],['Pterocladiella tenuis'],2,3,4.9058917760849 5095,3728,886,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.2440927,ISDB,,,,,,,XMLQEJGSKUOKGP,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9763708114624023 5096,3726,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1potassium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 5097,3723,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.76699597,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya paniculata,81668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya paniculata'],4,3,8.567983865737915 5098,3723,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.76699597,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya exotica,755734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya exotica'],4,3,8.567983865737915 5099,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 5100,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 5101,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5102,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5103,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5 5104,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 5105,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 5106,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5107,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 5108,3722,61,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1proton1ammonium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5 5109,3721,614,Fatty acids,Glycerophospholipids,Glycerophosphates,0.20063996,ISDB,OQUSJSFJUXJRDA-RGNLDTJCSA-N,"InChI=1S/C29H36O3/c1-21(2)7-5-8-22(3)9-6-10-23(4)11-18-27-28(31)19-25(20-29(27)32)13-12-24-14-16-26(30)17-15-24/h7,9,11-17,19-20,30-32H,5-6,8,10,18H2,1-4H3/b13-12+,22-9+,23-11+",CC(C)=CCC/C(C)=C/CC/C(C)=C/Cc1c(O)cc(/C=C/c2ccc(O)cc2)cc1O,C29H36O3,,432.2664450119999,OQUSJSFJUXJRDA,Shikimates and Phenylpropanoids,Stilbenoids,Monomeric stilbenes,Macaranga schweinfurthii,339743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Macaranga'],['Macaranga schweinfurthii'],4,0,4.802559852600098 5110,3720,-1,,,,0.0,MS1_match,XNBHVNRFMHXLMZ-ODLFONTESA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19+,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_1_1proton1methanol,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,0,6.0 5111,3720,-1,,,,0.0,MS1_match,XNBHVNRFMHXLMZ-ODLFONTESA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19+,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_1_1proton1methanol,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia saniculifolia,139326.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia saniculifolia'],6,0,6.0 5112,3720,-1,,,,0.0,MS1_match,XNBHVNRFMHXLMZ-FJSYSMJUSA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19-,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_1_1proton1methanol,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 5113,3718,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.63550794,ISDB,GBHKLFZDHYFGKG-UHFFFAOYSA-N,"InChI=1S/C26H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-21-25(27)23(2)26(28)22-24/h21-22,27-28H,3-20H2,1-2H3",CCCCCCCCCCCCCCCCCCCc1cc(O)c(C)c(O)c1,C26H46O2,,390.3497807119999,GBHKLFZDHYFGKG,Polyketides,Aromatic polyketides,Catechols with side chains,Polygonum glaucum,5746666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Polygonaceae'],['Polygoneae'],['Polygonum'],['Polygonum glaucum'],4,0,6.542031764984131 5114,3718,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.63550794,ISDB,GBHKLFZDHYFGKG-UHFFFAOYSA-N,"InChI=1S/C26H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-21-25(27)23(2)26(28)22-24/h21-22,27-28H,3-20H2,1-2H3",CCCCCCCCCCCCCCCCCCCc1cc(O)c(C)c(O)c1,C26H46O2,,390.3497807119999,GBHKLFZDHYFGKG,Polyketides,Aromatic polyketides,Catechols with side chains,Polygonum maritimum,338759.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Polygonaceae'],['Polygoneae'],['Polygonum'],['Polygonum maritimum'],4,0,6.542031764984131 5115,3717,-1,,,,0.0,MS1_match,CIDJXBNFIKRPHX-UHFFFAOYSA-N,"InChI=1S/C13H12O3/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13-16H",Oc1ccc(C(O)c2ccc(O)cc2)cc1,C13H12O3,pos_1_1proton1acetonitrile,216.078644244,CIDJXBNFIKRPHX,Shikimates and Phenylpropanoids,,,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 5116,3715,-1,,,,0.20611899,ISDB,FVWJYYTZTCVBKE-ROUWMTJPSA-N,"InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1",C=C(C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H50O2,,442.38108084,FVWJYYTZTCVBKE,Terpenoids,Triterpenoids,Lupane triterpenoids,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.824475944042206 5117,3714,820,Terpenoids,Sesquiterpenoids,Abeoabietane diterpenoids,0.0,MS1_match,MLGLJFWISHCOAE-UHFFFAOYSA-N,"InChI=1S/C17H20O4/c1-16(2)5-4-6-17(3)10-8-12(19)11(18)7-9(10)13(20)14(21)15(16)17/h7-8,18-19,21H,4-6H2,1-3H3",CC1(C)CCCC2(C)C1=C(O)C(=O)c1cc(O)c(O)cc12,C17H20O4,pos_2MH,288.13615912,MLGLJFWISHCOAE,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Celastrus stephanotifolius,6092505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus stephanotifolius'],6,3,7.5 5118,3714,820,Terpenoids,Sesquiterpenoids,Abeoabietane diterpenoids,0.0,MS1_match,MLGLJFWISHCOAE-QGZVFWFLSA-N,"InChI=1S/C17H20O4/c1-16(2)5-4-6-17(3)10-8-12(19)11(18)7-9(10)13(20)14(21)15(16)17/h7-8,18-19,21H,4-6H2,1-3H3/t17-/m1/s1",CC1(C)CCC[C@@]2(C)C1=C(O)C(=O)c1cc(O)c(O)cc12,C17H20O4,pos_2MH,288.13615912,MLGLJFWISHCOAE,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 5119,3710,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.26038572,ISDB,UGSHXVXFFPLXBZ-YCIZVOMOSA-N,"InChI=1S/C14H22O4/c1-9-5-6-13(10(2)7-17-11(3)15)14(9)8-18-12(4)16/h7,9,13-14H,5-6,8H2,1-4H3/b10-7+/t9-,13-,14+/m0/s1",CC(=O)O/C=C(\C)[C@@H]1CC[C@H](C)[C@H]1COC(C)=O,C14H22O4,,254.151809184,UGSHXVXFFPLXBZ,Terpenoids,,,Nepeta ciliaris,6082678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta ciliaris'],4,1,5.541542887687683 5120,3709,-1,,,,0.0,MS1_match,VTSMNIMXMILUTB-SNRVRTNWSA-N,"InChI=1S/C30H38O5/c1-26-11-12-27(2,25(34)35-6)16-23(26)29(4)10-8-21-19-15-22(32)24(33)20(17-31)18(19)7-9-28(21,3)30(29,5)14-13-26/h7-9,15,17,23,32-33H,10-14,16H2,1-6H3/t23-,26+,27+,28+,29-,30+/m0/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@@]3(C)[C@@](C)(CC=C4c5cc(O)c(O)c(C=O)c5C=C[C@]43C)[C@H]2C1,C30H38O5,pos_1_1proton1ammonium,478.2719243159999,VTSMNIMXMILUTB,Polyketides,Meroterpenoids,,Kokoona zeylanica,6092887.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Kokoona'],['Kokoona zeylanica'],6,0,6.0 5121,3709,-1,,,,0.0,MS1_match,MTZSYUQVIKIBDX-KLGNMXTRSA-N,"InChI=1S/C30H38O5/c1-17-18-8-9-21-27(3,19(18)14-20(31)24(17)33)11-13-30(6)22-15-28(4,25(34)35-7)23(32)16-26(22,2)10-12-29(21,30)5/h8-9,14,22,33H,10-13,15-16H2,1-7H3/t22-,26+,27+,28+,29-,30+/m1/s1",COC(=O)[C@@]1(C)C[C@@H]2[C@@](C)(CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]23C)CC1=O,C30H38O5,pos_1_1proton1ammonium,478.2719243159999,MTZSYUQVIKIBDX,Terpenoids,Triterpenoids,,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 5122,3709,-1,,,,0.0,MS1_match,MTZSYUQVIKIBDX-KLGNMXTRSA-N,"InChI=1S/C30H38O5/c1-17-18-8-9-21-27(3,19(18)14-20(31)24(17)33)11-13-30(6)22-15-28(4,25(34)35-7)23(32)16-26(22,2)10-12-29(21,30)5/h8-9,14,22,33H,10-13,15-16H2,1-7H3/t22-,26+,27+,28+,29-,30+/m1/s1",COC(=O)[C@@]1(C)C[C@@H]2[C@@](C)(CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]23C)CC1=O,C30H38O5,pos_1_1proton1ammonium,478.2719243159999,MTZSYUQVIKIBDX,Terpenoids,Triterpenoids,,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 5123,3709,-1,,,,0.0,MS1_match,AKILTDMBUDIAST-KILMDDQQSA-N,"InChI=1S/C30H38O5/c1-16-13-27(3)15-23(32)30(6,26(34)35-7)14-22(27)29(5)11-10-28(4)19(24(16)29)9-8-18-17(2)25(33)21(31)12-20(18)28/h8-9,12,22-23,32-33H,10-11,13-15H2,1-7H3/t22-,23+,27+,28-,29+,30+/m1/s1",COC(=O)[C@@]1(C)C[C@@H]2[C@@](C)(CC(C)=C3C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@]32C)C[C@@H]1O,C30H38O5,pos_1_1proton1ammonium,478.271924316,AKILTDMBUDIAST,Terpenoids,Triterpenoids,,Cheiloclinium cognatum,583081.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Cheiloclinium'],['Cheiloclinium cognatum'],6,0,6.0 5124,3709,-1,,,,0.0,MS1_match,AKILTDMBUDIAST-NQEVMONISA-N,"InChI=1S/C30H38O5/c1-16-13-27(3)15-23(32)30(6,26(34)35-7)14-22(27)29(5)11-10-28(4)19(24(16)29)9-8-18-17(2)25(33)21(31)12-20(18)28/h8-9,12,22-23,32-33H,10-11,13-15H2,1-7H3/t22-,23-,27-,28+,29-,30-/m0/s1",COC(=O)[C@@]1(C)C[C@H]2[C@@](C)(CC(C)=C3C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@]32C)C[C@@H]1O,C30H38O5,pos_1_1proton1ammonium,478.271924316,AKILTDMBUDIAST,Terpenoids,Triterpenoids,,Orthosphenia mexicana,755524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Orthosphenia'],['Orthosphenia mexicana'],6,0,6.0 5125,3709,-1,,,,0.0,MS1_match,AKILTDMBUDIAST-KILMDDQQSA-N,"InChI=1S/C30H38O5/c1-16-13-27(3)15-23(32)30(6,26(34)35-7)14-22(27)29(5)11-10-28(4)19(24(16)29)9-8-18-17(2)25(33)21(31)12-20(18)28/h8-9,12,22-23,32-33H,10-11,13-15H2,1-7H3/t22-,23+,27+,28-,29+,30+/m1/s1",COC(=O)[C@@]1(C)C[C@@H]2[C@@](C)(CC(C)=C3C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@]32C)C[C@@H]1O,C30H38O5,pos_1_1proton1ammonium,478.271924316,AKILTDMBUDIAST,Terpenoids,Triterpenoids,,Salacia cordata,321783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia cordata'],6,0,6.0 5126,3709,-1,,,,0.0,MS1_match,AKILTDMBUDIAST-KILMDDQQSA-N,"InChI=1S/C30H38O5/c1-16-13-27(3)15-23(32)30(6,26(34)35-7)14-22(27)29(5)11-10-28(4)19(24(16)29)9-8-18-17(2)25(33)21(31)12-20(18)28/h8-9,12,22-23,32-33H,10-11,13-15H2,1-7H3/t22-,23+,27+,28-,29+,30+/m1/s1",COC(=O)[C@@]1(C)C[C@@H]2[C@@](C)(CC(C)=C3C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@]32C)C[C@@H]1O,C30H38O5,pos_1_1proton1ammonium,478.271924316,AKILTDMBUDIAST,Terpenoids,Triterpenoids,,Salacia petenensis,578095.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia petenensis'],6,0,6.0 5127,3709,-1,,,,0.0,MS1_match,XIOMLVAPKXPLRW-UHFFFAOYSA-N,"InChI=1S/C28H38O5/c1-14-11-19-26(4,24(33)22(14)31)8-10-28(6)20-13-17(29)21-15(2)23(32)18(30)12-16(21)25(20,3)7-9-27(19,28)5/h12,14,19-20,24,30,32-33H,7-11,13H2,1-6H3",Cc1c(O)c(O)cc2c1C(=O)CC1C2(C)CCC2(C)C3CC(C)C(=O)C(O)C3(C)CCC12C,C28H38O5,pos_1_1proton1acetonitrile,454.271924316,XIOMLVAPKXPLRW,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 5128,3709,-1,,,,0.0,MS1_match,XIOMLVAPKXPLRW-VUTOXQPKSA-N,"InChI=1S/C28H38O5/c1-14-11-19-26(4,24(33)22(14)31)8-10-28(6)20-13-17(29)21-15(2)23(32)18(30)12-16(21)25(20,3)7-9-27(19,28)5/h12,14,19-20,24,30,32-33H,7-11,13H2,1-6H3/t14-,19-,20+,24-,25+,26-,27+,28-/m1/s1",Cc1c(O)c(O)cc2c1C(=O)C[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H38O5,pos_1_1proton1acetonitrile,454.271924316,XIOMLVAPKXPLRW,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 5129,3709,-1,,,,0.0,MS1_match,XIOMLVAPKXPLRW-VUTOXQPKSA-N,"InChI=1S/C28H38O5/c1-14-11-19-26(4,24(33)22(14)31)8-10-28(6)20-13-17(29)21-15(2)23(32)18(30)12-16(21)25(20,3)7-9-27(19,28)5/h12,14,19-20,24,30,32-33H,7-11,13H2,1-6H3/t14-,19-,20+,24-,25+,26-,27+,28-/m1/s1",Cc1c(O)c(O)cc2c1C(=O)C[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H38O5,pos_1_1proton1acetonitrile,454.271924316,XIOMLVAPKXPLRW,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia amazonica,6092911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia amazonica'],6,0,6.0 5130,3709,-1,,,,0.0,MS1_match,XIOMLVAPKXPLRW-VUTOXQPKSA-N,"InChI=1S/C28H38O5/c1-14-11-19-26(4,24(33)22(14)31)8-10-28(6)20-13-17(29)21-15(2)23(32)18(30)12-16(21)25(20,3)7-9-27(19,28)5/h12,14,19-20,24,30,32-33H,7-11,13H2,1-6H3/t14-,19-,20+,24-,25+,26-,27+,28-/m1/s1",Cc1c(O)c(O)cc2c1C(=O)C[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H38O5,pos_1_1proton1acetonitrile,454.271924316,XIOMLVAPKXPLRW,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus amazonica,6092911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia amazonica'],6,0,6.0 5131,3709,-1,,,,0.0,MS1_match,AXTDWQFUQQFNPB-HPSZYYLOSA-N,"InChI=1S/C28H38O5/c1-16-14-21-26(4,24(32)23(16)31)11-13-27(5)20-9-8-18(17(2)29)19(15-22(30)33-7)25(20,3)10-12-28(21,27)6/h8-9,15-16,21,24,32H,10-14H2,1-7H3/b19-15+/t16-,21-,24-,25+,26-,27-,28+/m1/s1",COC(=O)/C=C1\C(C(C)=O)=CC=C2[C@@]1(C)CC[C@@]1(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]21C,C28H38O5,pos_1_1proton1acetonitrile,454.271924316,AXTDWQFUQQFNPB,Terpenoids,Triterpenoids,Friedelane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 5132,3709,-1,,,,0.0,MS1_match,RULSDOXKRPWOHN-HPEBJJJSSA-N,"InChI=1S/C28H38O5/c1-16(29)17-9-10-19-25(4,18(17)15-20(30)33-8)11-14-28(7)23-24(2,3)21(31)22(32)26(23,5)12-13-27(19,28)6/h9-10,15,22-23,32H,11-14H2,1-8H3/b18-15-/t22-,23-,25+,26+,27-,28+/m1/s1",COC(=O)/C=C1/C(C(C)=O)=CC=C2[C@@]1(C)CC[C@@]1(C)[C@@H]3C(C)(C)C(=O)[C@@H](O)[C@]3(C)CC[C@]21C,C28H38O5,pos_1_1proton1acetonitrile,454.271924316,RULSDOXKRPWOHN,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 5133,3709,-1,,,,0.0,MS1_match,XQNCHKOLFLXEDX-GDRWMMEVSA-N,"InChI=1S/C28H38O5/c1-14-11-20-26(4,24(33)21(14)31)8-10-28(6)23-19(30)12-16-15(2)22(32)18(29)13-17(16)25(23,3)7-9-27(20,28)5/h12-14,19-20,23-24,30,32-33H,7-11H2,1-6H3/t14-,19-,20-,23+,24-,25+,26-,27+,28-/m1/s1",CC1=C(O)C(=O)C=C2C1=C[C@@H](O)[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H38O5,pos_1_1proton1acetonitrile,454.271924316,XQNCHKOLFLXEDX,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia macrocarpa,7631453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia macrocarpa'],6,0,6.0 5134,3709,-1,,,,0.0,MS1_match,GNNQINKXWHFSIK-FQYKMUNDSA-N,"InChI=1S/C30H41NO5/c1-5-31-16-28(2)12-11-23(36-27(32)17-9-7-6-8-10-17)30-19-13-18-21(34-3)15-29(33,24(19)25(18)35-4)20(26(30)31)14-22(28)30/h6-10,18-26,33H,5,11-16H2,1-4H3/t18-,19-,20+,21+,22-,23+,24-,25+,26-,28-,29+,30-/m1/s1",CCN1C[C@@]2(C)CC[C@H](OC(=O)c3ccccc3)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C30H41NO5,pos_1_1proton,495.298473412,GNNQINKXWHFSIK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 5135,3708,-1,,,,0.24699987,ISDB,ZPQZZXCFLMFYOG-VTSKZAQASA-N,"InChI=1S/C19H20N2O6/c1-9(22)27-15-14-10-8-26-16(15)19(7-12(10)20-17(14)23)11-5-3-4-6-13(11)21(25-2)18(19)24/h3-6,10,12,14-16H,7-8H2,1-2H3,(H,20,23)/t10-,12+,14+,15-,16-,19+/m1/s1",CON1C(=O)[C@@]2(C[C@@H]3NC(=O)[C@H]4[C@@H]3CO[C@@H]2[C@@H]4OC(C)=O)c2ccccc21,C19H20N2O6,,372.13213636,ZPQZZXCFLMFYOG,Alkaloids,,,Gelsemium elegans,257885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gelsemiaceae'],['Unknown'],['Gelsemium'],['Gelsemium elegans'],4,0,4.987999498844147 5136,3706,-1,,,,0.0,MS1_match,IGODOXYLBBXFDW-NSHDSACASA-N,"InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3/t11-/m0/s1",CC(=O)OC(C)(C)[C@H]1CC=C(C)CC1,C12H20O2,pos_2MHCH3CN,196.14632988,IGODOXYLBBXFDW,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5137,3706,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-UHFFFAOYSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3",CC(=O)OC1CC2CCC1(C)C2(C)C,C12H20O2,pos_2MHCH3CN,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5138,3706,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-UHFFFAOYSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3",CC(=O)OC1CC2CCC1(C)C2(C)C,C12H20O2,pos_2MHCH3CN,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana celtica,21455.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana celtica'],6,0,6.0 5139,3706,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-HOSYDEDBSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1",CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C12H20O2,pos_2MHCH3CN,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5140,3706,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-HOSYDEDBSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1",CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C12H20O2,pos_2MHCH3CN,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana hardwickii,139324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana hardwickii'],6,0,6.0 5141,3706,-1,,,,0.0,MS1_match,KGEKLUUHTZCSIP-HOSYDEDBSA-N,"InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,12+/m0/s1",CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C12H20O2,pos_2MHCH3CN,196.14632988,KGEKLUUHTZCSIP,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana moonii,139324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana hardwickii'],6,0,6.0 5142,3704,-1,,,,0.0,MS1_match,VEDTYRJAYMXHSG-YGRZPYPDSA-N,"InChI=1S/C30H50O4/c1-25(17-31)15-20-19-7-8-22-27(3)11-10-23(33)28(4,18-32)21(27)9-12-30(22,6)29(19,5)14-13-26(20,2)24(34)16-25/h7,20-24,31-34H,8-18H2,1-6H3/t20-,21+,22+,23-,24+,25-,26+,27-,28+,29+,30+/m0/s1",C[C@@]1(CO)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H50O4,pos_1_1proton1ammonium,474.37091008,VEDTYRJAYMXHSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 5143,3704,-1,,,,0.0,MS1_match,VEDTYRJAYMXHSG-YGRZPYPDSA-N,"InChI=1S/C30H50O4/c1-25(17-31)15-20-19-7-8-22-27(3)11-10-23(33)28(4,18-32)21(27)9-12-30(22,6)29(19,5)14-13-26(20,2)24(34)16-25/h7,20-24,31-34H,8-18H2,1-6H3/t20-,21+,22+,23-,24+,25-,26+,27-,28+,29+,30+/m0/s1",C[C@@]1(CO)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H50O4,pos_1_1proton1ammonium,474.37091008,VEDTYRJAYMXHSG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 5144,3704,-1,,,,0.0,MS1_match,SBMFUYVWTXYRCJ-WQANCUIESA-N,"InChI=1S/C30H50O4/c1-18(2)7-8-20(32)19(3)25-21(33)15-28(6)23-10-9-22-26(4,17-31)24(34)11-12-29(22)16-30(23,29)14-13-27(25,28)5/h7,19-25,31-34H,8-17H2,1-6H3/t19-,20+,21+,22+,23+,24+,25+,26+,27-,28+,29-,30+/m1/s1",CC(C)=CC[C@H](O)[C@@H](C)[C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4[C@](C)(CO)[C@@H](O)CC[C@@]45C[C@@]35CC[C@]12C,C30H50O4,pos_1_1proton1ammonium,474.37091008,SBMFUYVWTXYRCJ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 5145,3704,-1,,,,0.0,MS1_match,CDDWAYFUFNQLRZ-KJVHGCRFSA-N,"InChI=1S/C30H50O4/c1-25(2)16-19-18-8-9-21-27(4)12-11-22(32)28(5,17-31)20(27)10-13-30(21,7)29(18,6)15-14-26(19,3)24(34)23(25)33/h8,19-24,31-34H,9-17H2,1-7H3/t19-,20+,21+,22-,23-,24+,26+,27-,28+,29+,30+/m0/s1",CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@H](O)[C@@H]1O,C30H50O4,pos_1_1proton1ammonium,474.37091008,CDDWAYFUFNQLRZ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 5146,3703,69,Terpenoids,Sesquiterpenoids,Furans,0.56750405,ISDB,CTLVRIOTFRWXKP-BGTYHANMSA-N,"InChI=1S/C18H28O/c1-13-7-6-8-16-17(13,4)11-9-14(2)18(16,5)12-10-15(3)19/h6-7,14,16H,1,8-12H2,2-5H3/t14-,16-,17+,18+/m1/s1",C=C1C=CC[C@H]2[C@@](C)(CCC(C)=O)[C@H](C)CC[C@@]12C,C18H28O,,260.214015516,CTLVRIOTFRWXKP,Terpenoids,Sesquiterpenoids,,Parentucellia latifolia,981066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Rhinantheae'],['Parentucellia'],['Parentucellia latifolia'],4,2,7.270016193389893 5147,3699,-1,,,,0.40801108,ISDB,FYBCOTZHIIDSOQ-FEBCWGDDSA-N,"InChI=1S/C20H32O/c1-6-19(4)12-9-15-14(13-19)7-8-16-18(2,3)11-10-17(21)20(15,16)5/h6,13,15-17,21H,1,7-12H2,2-5H3/t15?,16-,17-,19-,20+/m0/s1",C=C[C@]1(C)C=C2CC[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)C2CC1,C20H32O,,288.245315644,FYBCOTZHIIDSOQ,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Kaempferia,3462.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Kaempferia'],['Unknown'],4,0,5.632044315338135 5148,3699,-1,,,,0.40801108,ISDB,FYBCOTZHIIDSOQ-VDWQKOAOSA-N,"InChI=1S/C20H32O/c1-6-19(4)12-9-15-14(13-19)7-8-16-18(2,3)11-10-17(21)20(15,16)5/h6,13,15-17,21H,1,7-12H2,2-5H3/t15-,16-,17-,19-,20+/m0/s1",C=C[C@]1(C)C=C2CC[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)[C@H]2CC1,C20H32O,,288.245315644,FYBCOTZHIIDSOQ,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Kaempferia marginata,440800.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Kaempferia'],['Kaempferia marginata'],4,0,5.632044315338135 5149,3699,-1,,,,0.40801108,ISDB,FYBCOTZHIIDSOQ-VDWQKOAOSA-N,"InChI=1S/C20H32O/c1-6-19(4)12-9-15-14(13-19)7-8-16-18(2,3)11-10-17(21)20(15,16)5/h6,13,15-17,21H,1,7-12H2,2-5H3/t15-,16-,17-,19-,20+/m0/s1",C=C[C@]1(C)C=C2CC[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)[C@H]2CC1,C20H32O,,288.245315644,FYBCOTZHIIDSOQ,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Eria marginata,3979551.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Eria'],['Eria marginata'],4,0,5.632044315338135 5150,3699,-1,,,,0.40801108,ISDB,FYBCOTZHIIDSOQ-VDWQKOAOSA-N,"InChI=1S/C20H32O/c1-6-19(4)12-9-15-14(13-19)7-8-16-18(2,3)11-10-17(21)20(15,16)5/h6,13,15-17,21H,1,7-12H2,2-5H3/t15-,16-,17-,19-,20+/m0/s1",C=C[C@]1(C)C=C2CC[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)[C@H]2CC1,C20H32O,,288.245315644,FYBCOTZHIIDSOQ,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Kaempferia galanga,576124.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Kaempferia'],['Kaempferia galanga'],4,0,5.632044315338135 5151,3699,-1,,,,0.40801108,ISDB,FYBCOTZHIIDSOQ-VDWQKOAOSA-N,"InChI=1S/C20H32O/c1-6-19(4)12-9-15-14(13-19)7-8-16-18(2,3)11-10-17(21)20(15,16)5/h6,13,15-17,21H,1,7-12H2,2-5H3/t15-,16-,17-,19-,20+/m0/s1",C=C[C@]1(C)C=C2CC[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)[C@H]2CC1,C20H32O,,288.245315644,FYBCOTZHIIDSOQ,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Cylindrolobus marginatus,3979551.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Eria'],['Eria marginata'],4,0,5.632044315338135 5152,3697,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.35148275,ISDB,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.405930995941162 5153,3697,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.35148275,ISDB,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,2,8.405930995941162 5154,3697,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.35148275,ISDB,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana officinalis var. latifolia,430697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.405930995941162 5155,3696,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.8445866,ISDB,VNCWZYPKAQUABQ-XMMPIXPASA-N,"InChI=1S/C30H20O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-11,13,24,31-35H,12H2/t24-/m1/s1",O=C1C[C@H](c2ccc(Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O)cc2)Oc2cc(O)cc(O)c21,C30H20O10,,540.10564684,VNCWZYPKAQUABQ,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Luxemburgia nobilis,6102988.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Ochnaceae'],['Unknown'],['Luxemburgia'],['Luxemburgia nobilis'],4,3,8.87834644317627 5156,3696,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.8445866,ISDB,VNCWZYPKAQUABQ-XMMPIXPASA-N,"InChI=1S/C30H20O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-11,13,24,31-35H,12H2/t24-/m1/s1",O=C1C[C@H](c2ccc(Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O)cc2)Oc2cc(O)cc(O)c21,C30H20O10,,540.10564684,VNCWZYPKAQUABQ,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Quintinia acutifolia,5264187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Paracryphiales'],['Paracryphiaceae'],['Unknown'],['Quintinia'],['Quintinia acutifolia'],4,3,8.87834644317627 5157,3696,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.8445866,ISDB,VNCWZYPKAQUABQ-XMMPIXPASA-N,"InChI=1S/C30H20O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-11,13,24,31-35H,12H2/t24-/m1/s1",O=C1C[C@H](c2ccc(Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O)cc2)Oc2cc(O)cc(O)c21,C30H20O10,,540.10564684,VNCWZYPKAQUABQ,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Ochna integerrima,531924.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Ochnaceae'],['Unknown'],['Ochna'],['Ochna integerrima'],4,3,8.87834644317627 5158,3695,-1,,,,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5159,3695,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-UHFFFAOYSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O15,pos_1_1potassium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5160,3695,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-CTZRMUNLSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26-,27?/m0/s1",C[C@@H]1O[C@@H](O[C@H]2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_1potassium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 5161,3695,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-UHFFFAOYSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O15,pos_1_1potassium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5162,3695,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-CTZRMUNLSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26-,27?/m0/s1",C[C@@H]1O[C@@H](O[C@H]2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_1potassium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 5163,3695,-1,,,,0.0,MS1_match,USNPULRDBDVJAO-YRBSALHSSA-O,"InChI=1S/C27H30O15/c1-9-19(32)21(34)23(36)26(39-9)38-8-18-20(33)22(35)24(37)27(42-18)41-17-7-12-14(30)5-11(28)6-16(12)40-25(17)10-2-3-13(29)15(31)4-10/h2-7,9,18-24,26-27,32-37H,8H2,1H3,(H3-,28,29,30,31)/p+1/t9-,18+,19-,20+,21-,22+,23+,24+,26+,27+/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c(O)cc(O)cc4[o+]c3-c3ccc(O)c(O)c3)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C27H31O15+,pos_1_1potassium,595.16574671209,USNPULRDBDVJAO,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 5164,3695,-1,,,,0.0,MS1_match,XDMJJZUUHWWITI-IPOZFMEPSA-N,"InChI=1S/C27H30O15/c28-8-17-20(32)22(34)24(36)26(41-17)38-9-18-21(33)23(35)25(37)27(42-18)39-12-5-13(30)19-14(31)7-15(40-16(19)6-12)10-1-3-11(29)4-2-10/h1-7,17-18,20-30,32-37H,8-9H2/t17-,18-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O15,pos_1_1potassium,594.15847026,XDMJJZUUHWWITI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 5165,3692,468,Fatty acids,Sphingolipids,Ceramides,0.21815878,ISDB,GCGTXOVNNFGTPQ-JHOUSYSJSA-N,"InChI=1S/C34H69NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-33,36-37H,3-31H2,1-2H3,(H,35,38)/t32-,33+/m0/s1",CCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCCCCC,C34H69NO3,,539.527745068,GCGTXOVNNFGTPQ,Fatty acids,Sphingolipids,Ceramides,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,3,6.372635126113892 5166,3688,-1,,,,0.0,MS1_match,PRCDDNKVZQBPNG-YBWZTWLNSA-N,"InChI=1S/C18H30O3/c1-11-9-14(20-12(2)19)15-17(11,5)10-13-7-8-18(15,6)21-16(13,3)4/h11,13-15H,7-10H2,1-6H3/t11-,13-,14-,15-,17-,18+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@@]2(C)C[C@H]3CC[C@](C)(OC3(C)C)[C@H]12,C18H30O3,pos_2MNa,294.21949482,PRCDDNKVZQBPNG,Terpenoids,Sesquiterpenoids,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5167,3687,-1,,,,0.0,MS1_match,RDOIACMZJPLQIZ-UHFFFAOYSA-N,"InChI=1S/C29H44O4/c1-16-9-12-29(25(32)33)14-13-27(5)20(23(29)17(16)2)7-8-22-26(4)15-21(30)24(31)18(3)19(26)10-11-28(22,27)6/h7,16-17,19,21-24,30-31H,3,8-15H2,1-2,4-6H3,(H,32,33)",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C)C(C)CCC3(C(=O)O)CCC21C,C29H44O4,pos_1_1proton1acetonitrile,456.323959888,RDOIACMZJPLQIZ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 5168,3687,-1,,,,0.0,MS1_match,RDOIACMZJPLQIZ-UHFFFAOYSA-N,"InChI=1S/C29H44O4/c1-16-9-12-29(25(32)33)14-13-27(5)20(23(29)17(16)2)7-8-22-26(4)15-21(30)24(31)18(3)19(26)10-11-28(22,27)6/h7,16-17,19,21-24,30-31H,3,8-15H2,1-2,4-6H3,(H,32,33)",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C)C(C)CCC3(C(=O)O)CCC21C,C29H44O4,pos_1_1proton1acetonitrile,456.323959888,RDOIACMZJPLQIZ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 5169,3685,-1,,,,0.0,MS1_match,OZBFUQLOVFXDNK-VWYCJHECSA-N,"InChI=1S/C12H18O2/c1-7-5-11(14-8(2)13)10-6-9(7)12(10,3)4/h5,9-11H,6H2,1-4H3/t9-,10+,11+/m1/s1",CC(=O)O[C@H]1C=C(C)[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_1_1proton1methanol,194.130679816,OZBFUQLOVFXDNK,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5170,3685,-1,,,,0.0,MS1_match,GVZSSHYAFJPRJY-GARJFASQSA-N,"InChI=1S/C12H18O2/c1-7-10-5-9(12(7,3)4)6-11(10)14-8(2)13/h9-11H,1,5-6H2,2-4H3/t9-,10-,11+/m0/s1",C=C1[C@@H]2C[C@@H](C[C@H]2OC(C)=O)C1(C)C,C12H18O2,pos_1_1proton1methanol,194.130679816,GVZSSHYAFJPRJY,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5171,3685,-1,,,,0.0,MS1_match,RWENJYLCELUBAE-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-8(2)10-6-11(13-4)9(3)12(7-10)14-5/h6-8H,1-5H3",COc1cc(C(C)C)cc(OC)c1C,C12H18O2,pos_1_1proton1methanol,194.130679816,RWENJYLCELUBAE,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5172,3685,-1,,,,0.0,MS1_match,ALVJDUNBMKMTDC-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-12(2,3)10-8-9(13-4)6-7-11(10)14-5/h6-8H,1-5H3",COc1ccc(OC)c(C(C)(C)C)c1,C12H18O2,pos_1_1proton1methanol,194.130679816,ALVJDUNBMKMTDC,Shikimates and Phenylpropanoids,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5173,3685,-1,,,,0.0,MS1_match,PBWRFXQNNGSAQG-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3",C=C1C(OC(C)=O)CC2(C(C)C)CC12,C12H18O2,pos_1_1proton1methanol,194.130679816,PBWRFXQNNGSAQG,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5174,3685,-1,,,,0.0,MS1_match,BKATZVAUANSCKN-QWRGUYRKSA-N,"InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1",CC(=O)OCC1=CC[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_1_1proton1methanol,194.130679816,BKATZVAUANSCKN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5175,3683,-1,,,,0.3905668,ISDB,OEKUSRBIIZNLHZ-QHLUWSNTSA-N,"InChI=1S/C24H38O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-20,22,26-27H,4-12H2,1-3H3,(H,28,29)/t13-,14?,16?,17?,18?,19-,20+,22?,23+,24-/m1/s1",C[C@H](CCC(=O)O)C1CCC2C3C(C[C@H](O)[C@@]21C)[C@@]1(C)CCC(=O)CC1C[C@H]3O,C24H38O5,,406.271924316,OEKUSRBIIZNLHZ,Terpenoids,Steroids,Cholane steroids,Psychrobacter,1082389.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Gammaproteobacteria'],['Pseudomonadales'],['Moraxellaceae'],['Unknown'],['Psychrobacter'],['Unknown'],0,0,1.5622671842575073 5176,3683,-1,,,,0.3905668,ISDB,OEKUSRBIIZNLHZ-DJDNIQJZSA-N,"InChI=1S/C24H38O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-20,22,26-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1",C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(=O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C,C24H38O5,,406.271924316,OEKUSRBIIZNLHZ,Terpenoids,Steroids,Cholane steroids,Nocardioides simplex,647773.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Propionibacteriales'],['Nocardioidaceae'],['Unknown'],['Nocardioides'],['Pimelobacter simplex'],0,0,1.5622671842575073 5177,3682,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,ATBOMIWRCZXYSZ-XZBBILGWSA-N,"InChI=1S/C40H75O10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(44)50-38(36-49-51(45,46)48-34-37(42)33-41)35-47-39(43)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,37-38,41-42H,3-10,12,14-16,19-36H2,1-2H3,(H,45,46)/b13-11+,18-17+",CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC(O)CO,C40H75O10P,pos_2_1proton1potassium,746.50978523,ATBOMIWRCZXYSZ,Fatty acids,Glycerophospholipids,Glycerophosphoglycerols,Ranunculus glacialis,225728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus glacialis'],6,0,6.0 5178,3681,907,Fatty acids,Sphingolipids,Phytane diterpenoids,0.5450342,ISDB,,,,,,,PKGTXGSNXHEECJ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.1801369190216064 5179,3678,1166,Polyketides,Fatty esters,Wax monoesters,0.5569007,ISDB,JELHWUPDJFSSDO-UHFFFAOYSA-N,"InChI=1S/C22H41F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27-21(26)22(23,24)25/h2-20H2,1H3",CCCCCCCCCCCCCCCCCCCCOC(=O)C(F)(F)F,C22H41F3O2,,394.305865212,JELHWUPDJFSSDO,Fatty acids,Fatty esters,Wax monoesters,Terminalia chebula,987253.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Combretaceae'],['Unknown'],['Terminalia'],['Terminalia chebula'],4,3,7.72760272026062 5180,3675,391,Alkaloids,Ornithine alkaloids,Polyamines,0.6065139,ISDB,,,,,,,VWGZHNDNCJLJRW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.426055669784546 5181,3670,117,,,,0.39191842,ISDB,,,,,,,AEOPOJXVDKIMSQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.567673683166504 5182,3666,-1,,,,0.0,MS1_match,PUETUDUXMCLALY-UHFFFAOYSA-N,"InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3",COc1cc(CC(CO)C(CO)Cc2ccc(O)c(OC)c2)ccc1O,C20H26O6,pos_1_1potassium,362.172938552,PUETUDUXMCLALY,Shikimates and Phenylpropanoids,Lignans,Dibenzylbutane lignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 5183,3666,-1,,,,0.0,MS1_match,PUETUDUXMCLALY-UHFFFAOYSA-N,"InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3",COc1cc(CC(CO)C(CO)Cc2ccc(O)c(OC)c2)ccc1O,C20H26O6,pos_1_1potassium,362.172938552,PUETUDUXMCLALY,Shikimates and Phenylpropanoids,Lignans,Dibenzylbutane lignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 5184,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,KPDVIKCSTOVVEA-KZFFKTSUSA-N,"InChI=1S/C53H86O22/c1-23-32(58)41(74-44-38(64)36(62)40(28(20-55)71-44)73-43-37(63)35(61)34(60)27(19-54)70-43)39(65)45(69-23)75-42-33(59)26(57)21-68-46(42)72-31-11-12-49(4)29(50(31,5)22-56)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,47(66)67)17-15-51(24,52)6/h8,23,25-46,54-65H,9-22H2,1-7H3,(H,66,67)/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35-,36+,37+,38+,39+,40+,41+,42+,43-,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H]1O,C53H86O22,pos_2_2sodium,1074.561074392,KPDVIKCSTOVVEA,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5185,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,UIMSMPXWHBZAKD-DJCLAPGVSA-N,"InChI=1S/C53H86O22/c1-23-32(57)36(61)40(65)44(70-23)74-42-38(63)35(60)28(21-69-43-39(64)33(58)26(56)20-68-43)72-46(42)75-47(67)53-16-14-48(2,3)18-25(53)24-8-9-30-49(4)12-11-31(73-45-41(66)37(62)34(59)27(19-54)71-45)50(5,22-55)29(49)10-13-52(30,7)51(24,6)15-17-53/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33+,34+,35+,36+,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(CO)[C@@H]6CC[C@@]5(C)[C@]3(C)CC4)O[C@H](CO[C@H]3OC[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2sodium,1074.561074392,UIMSMPXWHBZAKD,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5186,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,GFPLPBCJRRNZHM-ICUGHKHQSA-N,"InChI=1S/C53H86O22/c1-23-32(57)36(61)40(65)44(70-23)74-42-33(58)26(56)20-68-46(42)73-31-11-12-49(4)29(50(31,5)22-55)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,17-15-51(24,52)6)47(67)75-45-41(66)38(63)35(60)28(72-45)21-69-43-39(64)37(62)34(59)27(19-54)71-43/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2sodium,1074.5610743920006,GFPLPBCJRRNZHM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5187,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,FNNMEJXCIARVCO-ZZSPFVKRSA-N,"InChI=1S/C53H86O22/c1-48(2)14-16-53(47(67)75-45-41(66)38(63)35(60)28(72-45)22-69-43-39(64)36(61)33(58)26(19-54)70-43)17-15-51(6)23(24(53)18-48)8-9-30-50(5)12-11-31(49(3,4)29(50)10-13-52(30,51)7)73-46-42(32(57)25(56)21-68-46)74-44-40(65)37(62)34(59)27(20-55)71-44/h8,24-46,54-66H,9-22H2,1-7H3/t24-,25+,26+,27+,28+,29-,30+,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,42-,43+,44-,45-,46-,50-,51+,52+,53-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C53H86O22,pos_2_2sodium,1074.561074392,FNNMEJXCIARVCO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,1,7.5 5188,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,FNNMEJXCIARVCO-WGCVIKQWSA-N,"InChI=1S/C53H86O22/c1-48(2)14-16-53(47(67)75-45-41(66)38(63)35(60)28(72-45)22-69-43-39(64)36(61)33(58)26(19-54)70-43)17-15-51(6)23(24(53)18-48)8-9-30-50(5)12-11-31(49(3,4)29(50)10-13-52(30,51)7)73-46-42(32(57)25(56)21-68-46)74-44-40(65)37(62)34(59)27(20-55)71-44/h8,24-46,54-66H,9-22H2,1-7H3/t24-,25-,26+,27+,28+,29-,30+,31-,32-,33+,34+,35+,36-,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,50-,51+,52+,53-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C53H86O22,pos_2_2sodium,1074.5610743920004,FNNMEJXCIARVCO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5189,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,GFPLPBCJRRNZHM-ICUGHKHQSA-N,"InChI=1S/C53H86O22/c1-23-32(57)36(61)40(65)44(70-23)74-42-33(58)26(56)20-68-46(42)73-31-11-12-49(4)29(50(31,5)22-55)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,17-15-51(24,52)6)47(67)75-45-41(66)38(63)35(60)28(72-45)21-69-43-39(64)37(62)34(59)27(19-54)71-43/h8,23,25-46,54-66H,9-22H2,1-7H3/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C53H86O22,pos_2_2sodium,1074.5610743920006,GFPLPBCJRRNZHM,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5190,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,FNNMEJXCIARVCO-WGCVIKQWSA-N,"InChI=1S/C53H86O22/c1-48(2)14-16-53(47(67)75-45-41(66)38(63)35(60)28(72-45)22-69-43-39(64)36(61)33(58)26(19-54)70-43)17-15-51(6)23(24(53)18-48)8-9-30-50(5)12-11-31(49(3,4)29(50)10-13-52(30,51)7)73-46-42(32(57)25(56)21-68-46)74-44-40(65)37(62)34(59)27(20-55)71-44/h8,24-46,54-66H,9-22H2,1-7H3/t24-,25-,26+,27+,28+,29-,30+,31-,32-,33+,34+,35+,36-,37-,38-,39+,40+,41+,42+,43+,44-,45-,46-,50-,51+,52+,53-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C53H86O22,pos_2_2sodium,1074.5610743920004,FNNMEJXCIARVCO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5191,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,KPDVIKCSTOVVEA-KZFFKTSUSA-N,"InChI=1S/C53H86O22/c1-23-32(58)41(74-44-38(64)36(62)40(28(20-55)71-44)73-43-37(63)35(61)34(60)27(19-54)70-43)39(65)45(69-23)75-42-33(59)26(57)21-68-46(42)72-31-11-12-49(4)29(50(31,5)22-56)10-13-52(7)30(49)9-8-24-25-18-48(2,3)14-16-53(25,47(66)67)17-15-51(24,52)6/h8,23,25-46,54-65H,9-22H2,1-7H3,(H,66,67)/t23-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35-,36+,37+,38+,39+,40+,41+,42+,43-,44-,45-,46-,49-,50-,51+,52+,53-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H]1O,C53H86O22,pos_2_2sodium,1074.561074392,KPDVIKCSTOVVEA,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5192,3665,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,FNNMEJXCIARVCO-ZZSPFVKRSA-N,"InChI=1S/C53H86O22/c1-48(2)14-16-53(47(67)75-45-41(66)38(63)35(60)28(72-45)22-69-43-39(64)36(61)33(58)26(19-54)70-43)17-15-51(6)23(24(53)18-48)8-9-30-50(5)12-11-31(49(3,4)29(50)10-13-52(30,51)7)73-46-42(32(57)25(56)21-68-46)74-44-40(65)37(62)34(59)27(20-55)71-44/h8,24-46,54-66H,9-22H2,1-7H3/t24-,25+,26+,27+,28+,29-,30+,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,42-,43+,44-,45-,46-,50-,51+,52+,53-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C53H86O22,pos_2_2sodium,1074.561074392,FNNMEJXCIARVCO,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,1,7.5 5193,3664,-1,,,,0.43741226,ISDB,QEKUAMYPTPQAPS-JBLDHEPKSA-N,"InChI=1S/C12H18O5/c1-6(2)10-9(17-7(3)14)4-8(5-13)11(15)12(10)16/h4,6,9-10,12-13,16H,5H2,1-3H3/t9-,10-,12+/m0/s1",CC(=O)O[C@H]1C=C(CO)C(=O)[C@H](O)[C@H]1C(C)C,C12H18O5,,242.115423676,QEKUAMYPTPQAPS,Terpenoids,,,Sphaeranthus suaveolens,4727388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Sphaeranthus'],['Sphaeranthus suaveolens'],4,0,5.7496490478515625 5194,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 5195,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana amurensis,245959.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana amurensis'],6,2,7.0 5196,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 5197,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 5198,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia caucasica,994163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia caucasica'],6,2,7.0 5199,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana ficariifolia,5746450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana ficariifolia'],6,2,7.0 5200,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 5201,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 5202,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,2,7.0 5203,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,2,7.0 5204,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Abelia chinensis,589178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Abelia'],['Abelia chinensis'],6,2,7.0 5205,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 5206,3659,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 5207,3657,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.5380442,ISDB,ZNJFBWYDHIGLCU-HWKXXFMVSA-N,"InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3-/t9-,10-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O,C12H18O3,,210.125594436,ZNJFBWYDHIGLCU,Fatty acids,Octadecanoids,Jasmonic acids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,8.152176856994629 5208,3655,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7541985,ISDB,AHANXAKGNAKFSK-UHFFFAOYSA-N,"InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)",CCC=CCC=CCC=CCCCCCCCCCC(=O)O,C20H34O2,,306.255880328,AHANXAKGNAKFSK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Prunus avium,162547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus avium'],4,3,8.516793966293335 5209,3655,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7541985,ISDB,AHANXAKGNAKFSK-UHFFFAOYSA-N,"InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)",CCC=CCC=CCC=CCCCCCCCCCC(=O)O,C20H34O2,,306.255880328,AHANXAKGNAKFSK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Punica granatum,646814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Punica'],['Punica granatum'],4,3,8.516793966293335 5210,3655,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7541985,ISDB,AHANXAKGNAKFSK-PDBXOOCHSA-N,"InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O,C20H34O2,,306.255880328,AHANXAKGNAKFSK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Elaeis guineensis,947656.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Arecales'],['Arecaceae'],['Cocoseae'],['Elaeis'],['Elaeis guineensis'],4,3,8.516793966293335 5211,3654,-1,,,,0.7271849,ISDB,OEJYWQCXHNOOHC-ZXEGGCGDSA-N,"InChI=1S/C24H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)32-23(21-26)22-31-33(28,29)30-20-19-25(2,3)4/h10-11,23,26H,5-9,12-22H2,1-4H3/b11-10-/t23-/m1/s1",CCCCCC/C=C\CCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])OCC[N+](C)(C)C,C24H48NO7P,,493.316839506,OEJYWQCXHNOOHC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Drosophila melanogaster,505714.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Diptera'],['Drosophilidae'],['Drosophilini'],['Drosophila'],['Drosophila melanogaster'],1,0,3.9087395668029785 5212,3654,-1,,,,0.7271849,ISDB,OEJYWQCXHNOOHC-ZXEGGCGDSA-N,"InChI=1S/C24H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)32-23(21-26)22-31-33(28,29)30-20-19-25(2,3)4/h10-11,23,26H,5-9,12-22H2,1-4H3/b11-10-/t23-/m1/s1",CCCCCC/C=C\CCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])OCC[N+](C)(C)C,C24H48NO7P,,493.316839506,OEJYWQCXHNOOHC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Saccharomyces cerevisiae,356221.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Unknown'],['Saccharomycetales'],['Saccharomycetaceae'],['Unknown'],['Saccharomyces'],['Saccharomyces cerevisiae'],1,0,3.9087395668029785 5213,3651,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,FGUCOPALAZXICJ-HNNXBMFYSA-O,"InChI=1S/C21H25NO4/c1-22(2)7-6-12-10-18(25-4)21(26-5)20-14-11-17(24-3)16(23)9-13(14)8-15(22)19(12)20/h9-11,15H,6-8H2,1-5H3/p+1/t15-/m0/s1",COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CC[N+]1(C)C,C21H26NO4+,pos_1_1proton2acetonitrile,356.1856347320899,FGUCOPALAZXICJ,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum foliolosum,124406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foliolosum'],6,0,6.0 5214,3644,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,XGRBHDJWRPUKMD-DQLDELGASA-N,"InChI=1S/C21H30O4/c1-12(2)14-10-15(23)18-13(19(14)25-5)6-7-16-20(18,3)9-8-17(24)21(16,4)11-22/h10,12,16,22-23H,6-9,11H2,1-5H3/t16-,20+,21-/m0/s1",COc1c(C(C)C)cc(O)c2c1CC[C@H]1[C@@]2(C)CCC(=O)[C@@]1(C)CO,C21H30O4,pos_2MCH3CNNa,346.21440943999994,XGRBHDJWRPUKMD,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,1,6.5 5215,3644,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,BDMIMSPBTFWTBC-YIOMQLLYSA-N,"InChI=1S/C21H30O4/c1-13(12-22)5-4-6-14(2)15-9-10-21(3)17(15)11-16-18(23)7-8-19(24)20(16)25-21/h5,9,14,17,19,22,24H,4,6-8,10-12H2,1-3H3/b13-5+/t14-,17+,19+,21+/m0/s1",C/C(=C\CC[C@H](C)C1=CC[C@@]2(C)OC3=C(C[C@H]12)C(=O)CC[C@H]3O)CO,C21H30O4,pos_2MCH3CNNa,346.21440944,BDMIMSPBTFWTBC,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Gymnosporia acuminata,906995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus hookeri'],6,1,6.5 5216,3644,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,KOATXBNOVXBDJE-GMOSXKBTSA-N,"InChI=1S/C21H30O4/c1-13(12-22)5-4-6-14(2)15-9-10-21(3)17(15)11-16-19(25-21)8-7-18(23)20(16)24/h5,9,14,17-18,22-23H,4,6-8,10-12H2,1-3H3/b13-5+/t14-,17+,18-,21-/m0/s1",C/C(=C\CC[C@H](C)C1=CC[C@]2(C)OC3=C(C[C@H]12)C(=O)[C@@H](O)CC3)CO,C21H30O4,pos_2MCH3CNNa,346.21440944,KOATXBNOVXBDJE,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Gymnosporia acuminata,906995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus hookeri'],6,1,6.5 5217,3644,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,KOATXBNOVXBDJE-GMOSXKBTSA-N,"InChI=1S/C21H30O4/c1-13(12-22)5-4-6-14(2)15-9-10-21(3)17(15)11-16-19(25-21)8-7-18(23)20(16)24/h5,9,14,17-18,22-23H,4,6-8,10-12H2,1-3H3/b13-5+/t14-,17+,18-,21-/m0/s1",C/C(=C\CC[C@H](C)C1=CC[C@]2(C)OC3=C(C[C@H]12)C(=O)[C@@H](O)CC3)CO,C21H30O4,pos_2MCH3CNNa,346.21440944,KOATXBNOVXBDJE,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Gymnosporia acuminata,906995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus hookeri'],6,1,6.5 5218,3644,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,DRRKGPWOHIAOQU-MAODMQOUSA-N,"InChI=1S/C21H30O4/c1-12(2)18-15(25-5)10-14-13(19(18)24)6-7-16-20(14,3)9-8-17(23)21(16,4)11-22/h10,12,16,22,24H,6-9,11H2,1-5H3/t16-,20-,21-/m1/s1",COc1cc2c(c(O)c1C(C)C)CC[C@H]1[C@@](C)(CO)C(=O)CC[C@]21C,C21H30O4,pos_2MCH3CNNa,346.21440944,DRRKGPWOHIAOQU,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,1,6.5 5219,3644,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HDOLTIKEXDYBAN-MAODMQOUSA-N,"InChI=1S/C21H30O4/c1-19(2,25-5)15-8-7-14-13(18(15)24)6-9-16-20(14,3)11-10-17(23)21(16,4)12-22/h7-8,16,22,24H,6,9-12H2,1-5H3/t16-,20-,21-/m1/s1",COC(C)(C)c1ccc2c(c1O)CC[C@H]1[C@@](C)(CO)C(=O)CC[C@]21C,C21H30O4,pos_2MCH3CNNa,346.21440944,HDOLTIKEXDYBAN,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Tripterygium doianum,293273.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium doianum'],6,1,6.5 5220,3642,943,Terpenoids,Steroids,Bufadienolides,0.0,MS1_match,HRCKZCPMAVHOGT-UHFFFAOYSA-N,"InChI=1S/C36H54O15/c1-34-9-7-18(48-32-30(45)28(43)31(23(14-38)50-32)51-33-29(44)27(42)26(41)22(13-37)49-33)11-17(34)4-5-20-19(34)8-10-35(2)25(21(39)12-36(20,35)46)16-3-6-24(40)47-15-16/h3,6,15,17-23,25-33,37-39,41-46H,4-5,7-14H2,1-2H3",CC12CCC(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)CC1CCC1C2CCC2(C)C(c3ccc(=O)oc3)C(O)CC12O,C36H54O15,pos_3_3sodium,726.346271028,HRCKZCPMAVHOGT,Terpenoids,Steroids,Bufadienolides,Helleborus thibetanus,948050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus thibetanus'],6,3,7.5 5221,3641,-1,,,,0.0,MS1_match,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,pos_2MCH3CNNa,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5222,3641,-1,,,,0.0,MS1_match,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,pos_2MCH3CNNa,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,0,6.0 5223,3641,-1,,,,0.0,MS1_match,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,pos_2MCH3CNNa,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5224,3640,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.3492767,ISDB,OBECEYKERBWXFA-CNGPOQNKSA-N,"InChI=1S/C24H40O11/c1-11-7-13(8-24(3,4)14(11)6-5-12(2)25)34-23-21(31)19(29)18(28)16(35-23)10-33-22-20(30)17(27)15(26)9-32-22/h5-6,11,13-23,26-31H,7-10H2,1-4H3/b6-5+/t11-,13+,14+,15-,16-,17+,18-,19+,20-,21-,22+,23-/m1/s1",CC(=O)/C=C/[C@H]1[C@H](C)C[C@H](O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C24H40O11,,504.2570621,OBECEYKERBWXFA,Terpenoids,Apocarotenoids,Megastigmanes,Alangium premnifolium,6045450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Cornaceae'],['Unknown'],['Alangium'],['Alangium premnifolium'],4,1,5.897106766700745 5225,3629,-1,,,,0.0,MS1_match,ZBRRQHJHHZFGNX-YQPXDFNPSA-N,"InChI=1S/C24H32NO10/c1-3-15-16(7-6-14-5-4-8-25(11-14)9-10-26)17(22(31)32-2)13-33-23(15)35-24-21(30)20(29)19(28)18(12-27)34-24/h3-8,11,13,15-16,18-21,23-24,26-30H,1,9-10,12H2,2H3/q+1/b7-6+/t15-,16+,18-,19-,20+,21-,23+,24+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1ccc[n+](CCO)c1,C24H32NO10+,pos_1_1proton1methanol,494.20207264409,ZBRRQHJHHZFGNX,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5226,3627,344,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 5227,3627,344,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 5228,3627,344,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Chromones,0.0,MS1_match,PBHOYFHVNTVOLB-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(8-30-21-19(29)18(28)17(27)15(7-23)32-21)2-3-11-12(24)5-14(26)16-13(25)4-10(6-22)31-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,PBHOYFHVNTVOLB,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 5229,3627,344,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,3,7.5 5230,3627,344,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 5231,3626,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.28823707,ISDB,XOGGREZGCFWEBP-KHYBMMPHSA-N,"InChI=1S/C25H28O12/c1-2-13-14-7-8-33-23(32)15(14)11-34-24(13)37-25-21(31)22(20(30)18(10-26)35-25)36-19(29)6-4-12-3-5-16(27)17(28)9-12/h2-6,9,11,13-14,18,20-22,24-28,30-31H,1,7-8,10H2/b6-4+/t13-,14+,18-,20-,21-,22+,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](OC(=O)/C=C/c3ccc(O)c(O)c3)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C25H28O12,,520.158076336,XOGGREZGCFWEBP,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Neolamarckia cadamba,919146.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Neolamarckia'],['Neolamarckia cadamba'],4,3,6.652948260307312 5232,3626,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.28823707,ISDB,XOGGREZGCFWEBP-KHYBMMPHSA-N,"InChI=1S/C25H28O12/c1-2-13-14-7-8-33-23(32)15(14)11-34-24(13)37-25-21(31)22(20(30)18(10-26)35-25)36-19(29)6-4-12-3-5-16(27)17(28)9-12/h2-6,9,11,13-14,18,20-22,24-28,30-31H,1,7-8,10H2/b6-4+/t13-,14+,18-,20-,21-,22+,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](OC(=O)/C=C/c3ccc(O)c(O)c3)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C25H28O12,,520.158076336,XOGGREZGCFWEBP,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Neonauclea purpurea,966697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Breonia'],['Breonia chinensis'],4,3,6.652948260307312 5233,3626,742,Shikimates and Phenylpropanoids,Flavonoids,Secoiridoid monoterpenoids,0.28823707,ISDB,XOGGREZGCFWEBP-UHFFFAOYSA-N,"InChI=1S/C25H28O12/c1-2-13-14-7-8-33-23(32)15(14)11-34-24(13)37-25-21(31)22(20(30)18(10-26)35-25)36-19(29)6-4-12-3-5-16(27)17(28)9-12/h2-6,9,11,13-14,18,20-22,24-28,30-31H,1,7-8,10H2",C=CC1C(OC2OC(CO)C(O)C(OC(=O)C=Cc3ccc(O)c(O)c3)C2O)OC=C2C(=O)OCCC21,C25H28O12,,520.158076336,XOGGREZGCFWEBP,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Breonia chinensis,966697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Breonia'],['Breonia chinensis'],4,3,6.652948260307312 5234,3624,-1,,,,0.0,MS1_match,YHCKEIOMLBIUQU-SEHFLPBWSA-N,"InChI=1S/C35H44O13/c1-8-20(2)31(41)44-19-32(5)27-28(40)30(47-25(38)15-14-23-12-10-9-11-13-23)34(7)24(46-26(39)18-43-21(3)36)16-17-33(6,42)35(34,48-32)29(27)45-22(4)37/h8-15,24,27-30,40,42H,16-19H2,1-7H3/b15-14+,20-8+/t24-,27+,28-,29+,30-,32?,33-,34-,35-/m0/s1",C/C=C(\C)C(=O)OCC1(C)O[C@]23[C@H](OC(C)=O)[C@H]1[C@H](O)[C@H](OC(=O)/C=C/c1ccccc1)[C@]2(C)[C@@H](OC(=O)COC(C)=O)CC[C@]3(C)O,C35H44O13,pos_1_1potassium,672.2781914679997,YHCKEIOMLBIUQU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Denhamia celastroides,806623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Denhamia'],['Denhamia celastroides'],6,0,6.0 5235,3618,-1,,,,0.0,MS1_match,UXHIWGLCVSNCJC-RITZIESXSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(37)32(4,23(31)9-12-34(24,33)6)19-43-28-27(39)26(38)22(36)18-42-28/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22-,23+,24+,25-,26-,27+,28-,31-,32-,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton1isopropanol,604.397518752,UXHIWGLCVSNCJC,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5236,3618,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-CTLZLALTSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22-,23+,24+,25-,26-,27+,28-,31-,32+,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton1isopropanol,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5237,3618,-1,,,,0.0,MS1_match,QUBNLZCADIYAFW-CTLZLALTSA-N,"InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22-,23+,24+,25-,26-,27+,28-,31-,32+,33+,34+,35-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C35H56O8,pos_1_1proton1isopropanol,604.397518752,QUBNLZCADIYAFW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5238,3613,372,Fatty acids,Fatty Acids and Conjugates,Fatty alcohols,0.0,MS1_match,XMHIUKTWLZUKEX-UHFFFAOYSA-N,"InChI=1S/C26H52O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28/h2-25H2,1H3,(H,27,28)",CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O,C26H52O2,pos_1_1proton1methanol,396.3967309039999,XMHIUKTWLZUKEX,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 5239,3613,372,Fatty acids,Fatty Acids and Conjugates,Fatty alcohols,0.0,MS1_match,XMHIUKTWLZUKEX-UHFFFAOYSA-N,"InChI=1S/C26H52O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28/h2-25H2,1H3,(H,27,28)",CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O,C26H52O2,pos_1_1proton1methanol,396.3967309039999,XMHIUKTWLZUKEX,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,2,7.0 5240,3612,-1,,,,0.26758593,ISDB,FTUGJEDDHXBMPK-NDEPHWFRSA-N,"InChI=1S/C28H40O3/c1-19(2)9-11-23-17-25(18-24(26(23)30-8)12-10-20(3)4)27(29)31-28(21(5)6)15-13-22(7)14-16-28/h9-10,13,17-18,21H,11-12,14-16H2,1-8H3/t28-/m0/s1",COc1c(CC=C(C)C)cc(C(=O)O[C@@]2(C(C)C)CC=C(C)CC2)cc1CC=C(C)C,C28H40O3,,424.29774514,FTUGJEDDHXBMPK,Terpenoids,,,Piper aduncum,110421.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper aduncum'],4,0,5.070343732833862 5241,3609,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.26940334,ISDB,OKDOOPKXOAEBFT-HBCLTNMHSA-N,"InChI=1S/C27H38O3/c1-20(11-7-12-22(3)19-28)9-6-10-21(2)13-8-15-27(5)16-14-24-18-25(29)17-23(4)26(24)30-27/h9,12-13,17-19,29H,6-8,10-11,14-16H2,1-5H3/b20-9+,21-13+,22-12+/t27-/m0/s1",C/C(C=O)=C\CC/C(C)=C/CC/C(C)=C/CC[C@@]1(C)CCc2cc(O)cc(C)c2O1,C27H38O3,,410.282095076,OKDOOPKXOAEBFT,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Garcinia kola,154999.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia kola'],4,1,5.577613353729248 5242,3608,-1,,,,0.21340658,ISDB,GWXJMPVVJCHQIB-NSQTZXJSSA-N,"InChI=1S/C26H33NO12/c1-34-17-10-13(4-6-15(17)29)5-7-20(30)39-25-23(33)22(32)19(12-28)38-26(25)37-16-11-18(35-2)24(36-3)21(31)14(16)8-9-27/h4-8,10,16,18-19,21-26,28-29,31-33H,11-12H2,1-3H3/b7-5-,14-8+/t16-,18+,19-,21+,22-,23+,24+,25-,26-/m1/s1",COc1cc(/C=C\C(=O)O[C@H]2[C@H](O[C@@H]3C[C@H](OC)[C@H](OC)[C@@H](O)/C3=C/C#N)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1O,C26H33NO12,,551.200275496,GWXJMPVVJCHQIB,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Simmondsia chinensis,864011.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Simmondsiaceae'],['Unknown'],['Simmondsia'],['Simmondsia chinensis'],4,0,4.853626310825348 5243,3608,-1,,,,0.21340658,ISDB,GWXJMPVVJCHQIB-WSVSSVRQSA-N,"InChI=1S/C26H33NO12/c1-34-17-10-13(4-6-15(17)29)5-7-20(30)39-25-23(33)22(32)19(12-28)38-26(25)37-16-11-18(35-2)24(36-3)21(31)14(16)8-9-27/h4-8,10,16,18-19,21-26,28-29,31-33H,11-12H2,1-3H3/b7-5+,14-8-/t16-,18+,19-,21+,22-,23+,24+,25-,26-/m1/s1",COc1cc(/C=C/C(=O)O[C@H]2[C@H](O[C@@H]3C[C@H](OC)[C@H](OC)[C@@H](O)/C3=C\C#N)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1O,C26H33NO12,,551.200275496,GWXJMPVVJCHQIB,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Simmondsia californica,864011.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Simmondsiaceae'],['Unknown'],['Simmondsia'],['Simmondsia chinensis'],4,0,4.853626310825348 5244,3603,-1,,,,0.0,MS1_match,IUSBVFZKQJGVEP-SNAWJCMRSA-N,"InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+",C/C=C/c1ccc(OC(C)=O)c(OC)c1,C12H14O3,pos_1_1proton2acetonitrile,206.094294308,IUSBVFZKQJGVEP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5245,3597,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.6044472,ISDB,PRNJXUQTUSFYLV-UHFFFAOYSA-N,"InChI=1S/C17H28O2/c1-7-17(6,19-16(5)18)13-9-12-15(4)11-8-10-14(2)3/h7,10,12H,1,8-9,11,13H2,2-6H3",C=CC(C)(CCC=C(C)CCC=C(C)C)OC(C)=O,C17H28O2,,264.208930136,PRNJXUQTUSFYLV,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,9.417788743972778 5246,3596,308,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.24759208,ISDB,,,,,,,FZWCTBPYXRTYEQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9903683066368103 5247,3591,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_2MH,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 5248,3589,137,Alkaloids,Lysine alkaloids,Polyamines,0.22215451,ISDB,WEVPJDIZBLFOEP-NYQDVAGCSA-N,"InChI=1S/C24H33NO2/c1-16(2)19-11-10-17(3)24(4,21(19)12-13-23(26)27-5)14-18-15-25-22-9-7-6-8-20(18)22/h6-9,15,17,21,25H,10-14H2,1-5H3/t17-,21-,24-/m1/s1",COC(=O)CC[C@@H]1C(=C(C)C)CC[C@@H](C)[C@@]1(C)Cc1c[nH]c2ccccc12,C24H33NO2,,367.25112929599993,WEVPJDIZBLFOEP,,,,Greenwayodendron suaveolens,956932.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Piptostigmateae'],['Greenwayodendron'],['Greenwayodendron suaveolens'],4,0,4.888618052005768 5249,3589,137,Alkaloids,Lysine alkaloids,Polyamines,0.22215451,ISDB,WEVPJDIZBLFOEP-NYQDVAGCSA-N,"InChI=1S/C24H33NO2/c1-16(2)19-11-10-17(3)24(4,21(19)12-13-23(26)27-5)14-18-15-25-22-9-7-6-8-20(18)22/h6-9,15,17,21,25H,10-14H2,1-5H3/t17-,21-,24-/m1/s1",COC(=O)CC[C@@H]1C(=C(C)C)CC[C@@H](C)[C@@]1(C)Cc1c[nH]c2ccccc12,C24H33NO2,,367.25112929599993,WEVPJDIZBLFOEP,,,,Polyalthia suaveolens,956932.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Piptostigmateae'],['Greenwayodendron'],['Greenwayodendron suaveolens'],4,0,4.888618052005768 5250,3588,-1,,,,0.0,MS1_match,DYYRDAOHGZJZRW-HNNXBMFYSA-N,"InChI=1S/C20H26O3/c1-11(2)14-10-13-7-6-12(3)16-15(21)8-9-20(4,5)23-19(17(13)16)18(14)22/h6-7,10-11,15,21-22H,8-9H2,1-5H3/t15-/m0/s1",Cc1ccc2cc(C(C)C)c(O)c3c2c1[C@@H](O)CCC(C)(C)O3,C20H26O3,pos_1_1proton,314.188194692,DYYRDAOHGZJZRW,Terpenoids,Diterpenoids,Secoabietane diterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 5251,3588,-1,,,,0.0,MS1_match,DYYRDAOHGZJZRW-HNNXBMFYSA-N,"InChI=1S/C20H26O3/c1-11(2)14-10-13-7-6-12(3)16-15(21)8-9-20(4,5)23-19(17(13)16)18(14)22/h6-7,10-11,15,21-22H,8-9H2,1-5H3/t15-/m0/s1",Cc1ccc2cc(C(C)C)c(O)c3c2c1[C@@H](O)CCC(C)(C)O3,C20H26O3,pos_1_1proton,314.188194692,DYYRDAOHGZJZRW,Terpenoids,Diterpenoids,Secoabietane diterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5252,3584,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.48596507,ISDB,OFAYIAUICPXDBC-QPSCCSFWSA-N,"InChI=1S/C15H24O/c1-10(2)12-5-6-15(4)9-13(16)7-11(3)14(15)8-12/h12-14,16H,1,3,5-9H2,2,4H3/t12-,13+,14+,15+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)CC(=C)[C@@H]2C1,C15H24O,,220.182715388,OFAYIAUICPXDBC,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,9.443860292434692 5253,3576,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.0,MS1_match,QGMXLNCOBCGXMO-HNNXBMFYSA-N,"InChI=1S/C16H25N3O2/c20-16-13-15(14-7-2-1-3-8-14)17-9-4-5-11-19(21)12-6-10-18-16/h1-3,7-8,15,17,21H,4-6,9-13H2,(H,18,20)/t15-/m0/s1",O=C1C[C@@H](c2ccccc2)NCCCCN(O)CCCN1,C16H25N3O2,pos_2MK,291.19467704,QGMXLNCOBCGXMO,Alkaloids,Ornithine alkaloids,Polyamines,Maytenus buxifolia,1060181.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus buxifolia'],6,0,6.0 5254,3568,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.20825782,ISDB,OMGGPLTZARDXEH-SFFZUTDPSA-N,"InChI=1S/C45H68O12/c1-26(14-13-19-40(6,7)50-12)31-17-20-43(11)33-18-21-45-34(44(33,25-52-45)23-22-42(31,43)10)15-16-35(41(45,8)9)57-39-38(55-30(5)49)37(54-29(4)48)36(53-28(3)47)32(56-39)24-51-27(2)46/h13,18-19,21,26,31-39H,14-17,20,22-25H2,1-12H3/b19-13+/t26-,31-,32-,33+,34+,35+,36-,37-,38-,39+,42-,43+,44+,45-/m1/s1",COC(C)(C)/C=C/C[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3C=C[C@@]45OC[C@]3(CC[C@]12C)[C@@H]4CC[C@H](O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O)C5(C)C,C45H68O12,,800.471077616,OMGGPLTZARDXEH,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Momordica charantia,955521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Momordiceae'],['Momordica'],['Momordica charantia'],4,2,5.8330312967300415 5255,3567,-1,,,,0.27555484,ISDB,UGDVDUDNGSZKIS-HRVVTOCWSA-N,"InChI=1S/C29H38O3/c1-16-9-7-11-21-13-25-27(18(3)26(16)21)19(4)28(32-25)31-24-14-22-12-8-10-17(2)29(22,6)15-23(24)20(5)30/h13,16-17,22H,7-12,14-15H2,1-6H3/t16-,17-,22+,29+/m0/s1",CC(=O)C1=C(Oc2oc3cc4c(c(C)c3c2C)[C@@H](C)CCC4)C[C@H]2CCC[C@H](C)[C@@]2(C)C1,C29H38O3,,434.282095076,UGDVDUDNGSZKIS,Terpenoids,Sesquiterpenoids,Noreremophilane sesquiterpenoids,Ligularia muliensis,7051955.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia muliensis'],4,0,5.102219343185425 5256,3566,-1,,,,0.25386843,ISDB,,,,,,,JYQWDHMBWDKSCX,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.01547372341156 5257,3563,109,Terpenoids,Diterpenoids,Estrane steroids,0.6579981,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.13199234008789 5258,3555,-1,,,,0.0,MS1_match,GGFAHFSRIITJIJ-NONSRLQASA-N,"InChI=1S/C11H16O4/c1-6-3-4-7-8(10(12)14-2)5-15-11(13)9(6)7/h5-7,9,11,13H,3-4H2,1-2H3/t6-,7+,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@H]2[C@@H]1CC[C@@H]2C,C11H16O4,pos_1_1proton1methanol,212.104858992,GGFAHFSRIITJIJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5259,3553,1649,Fatty acids,Glycerophospholipids,Glycerophosphoserines,0.45371297,ISDB,,,,,,,YGBTZLLCHJLFFA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.8148518800735474 5260,3546,700,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,WIIDBJNWXCWLKF-VVAXPEBGSA-N,"InChI=1S/C14H19NO8/c15-4-3-6-1-2-7(17)9(18)13(6)23-14-12(21)11(20)10(19)8(5-16)22-14/h1-3,7-14,16-21H,5H2/b6-3-/t7-,8-,9+,10-,11+,12-,13+,14+/m1/s1",N#C/C=C1/C=C[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C14H19NO8,pos_2_2proton3acetonitrile,329.111066568,WIIDBJNWXCWLKF,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Semiaquilegia adoxoides,781970.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Semiaquilegia'],['Semiaquilegia adoxoides'],6,1,6.5 5261,3546,700,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,WIIDBJNWXCWLKF-VVAXPEBGSA-N,"InChI=1S/C14H19NO8/c15-4-3-6-1-2-7(17)9(18)13(6)23-14-12(21)11(20)10(19)8(5-16)22-14/h1-3,7-14,16-21H,5H2/b6-3-/t7-,8-,9+,10-,11+,12-,13+,14+/m1/s1",N#C/C=C1/C=C[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C14H19NO8,pos_2_2proton3acetonitrile,329.111066568,WIIDBJNWXCWLKF,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Thalictrum orientale,6133349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum orientale'],6,1,6.5 5262,3545,-1,,,,0.0,MS1_match,PDSCSYLDRHAHOX-UHFFFAOYSA-N,"InChI=1S/C12H22O5/c1-3-5-7-16-11(14)9-10(13)12(15)17-8-6-4-2/h10,13H,3-9H2,1-2H3",CCCCOC(=O)CC(O)C(=O)OCCCC,C12H22O5,pos_2MHCH3CN,246.146723804,PDSCSYLDRHAHOX,Fatty acids,Fatty esters,Wax monoesters,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 5263,3540,-1,,,,0.0,MS1_match,SNWJEAGXJFVRPD-CZIWMOKQSA-N,"InChI=1S/C25H40O9/c1-14(2)7-20(27)31-11-17-12-32-24(34-22(29)9-16(5)6)23-18(17)10-19(26)25(23,30)13-33-21(28)8-15(3)4/h12,14-16,18-19,23-24,26,30H,7-11,13H2,1-6H3/t18-,19+,23-,24+,25-/m1/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1C[C@H](O)[C@]2(O)COC(=O)CC(C)C,C25H40O9,pos_1_1proton1methanol,484.26723286,SNWJEAGXJFVRPD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 5264,3539,-1,,,,0.0,MS1_match,SCYYILSHQOYTTA-CGNPOWQISA-N,"InChI=1S/C15H26O2/c1-9-5-6-11-10(9)7-12-13(16)8-15(11,4)17-14(12,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10-,11-,12+,13+,15+/m1/s1",C[C@@H]1CC[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,SCYYILSHQOYTTA,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 5265,3539,-1,,,,0.0,MS1_match,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,pos_1_1proton1methanol,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5266,3539,-1,,,,0.0,MS1_match,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,pos_1_1proton1methanol,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 5267,3539,-1,,,,0.0,MS1_match,FXNFQZVVVKRJEG-IWTMDLJTSA-N,"InChI=1S/C15H26O2/c1-10-4-5-13-12(10)8-11-6-7-14(13,2)17-15(11,3)9-16/h10-13,16H,4-9H2,1-3H3/t10-,11+,12-,13-,14-,15-/m0/s1",C[C@H]1CC[C@H]2[C@H]1C[C@H]1CC[C@]2(C)O[C@@]1(C)CO,C15H26O2,pos_1_1proton1methanol,238.193280072,FXNFQZVVVKRJEG,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5268,3539,-1,,,,0.0,MS1_match,MPYYVGIJHREDBO-SLEUVZQESA-N,"InChI=1S/C15H26O2/c1-10(2)8-13(16)17-12-9-11-6-7-15(12,5)14(11,3)4/h10-12H,6-9H2,1-5H3/t11-,12-,15+/m0/s1",CC(C)CC(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,MPYYVGIJHREDBO,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5269,3539,-1,,,,0.0,MS1_match,ZGRPWWDOSQIIIF-UHFFFAOYSA-N,"InChI=1S/C15H26O2/c1-10-5-8-13(16)12-7-6-11(14(2,3)17)9-15(10,12)4/h10-12,17H,5-9H2,1-4H3",CC1CCC(=O)C2CCC(C(C)(C)O)CC12C,C15H26O2,pos_1_1proton1methanol,238.193280072,ZGRPWWDOSQIIIF,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5270,3539,-1,,,,0.0,MS1_match,ZADVMZUKWWMSLQ-PVZBEVCSSA-N,"InChI=1S/C15H26O2/c1-9-7-12(16)13-11(9)8-10-5-6-15(13,4)17-14(10,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10+,11-,12-,13+,15-/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@@H]1CC[C@@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,ZADVMZUKWWMSLQ,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5271,3539,-1,,,,0.0,MS1_match,WKGPQOAMUAIBRO-KPRRGPHJSA-N,"InChI=1S/C15H26O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10-,11-,12-,14-,15+/m0/s1",C[C@H]1CC[C@@]2(O)C(C)(C)[C@H]3C[C@@H]1[C@]2(C)C[C@@H]3O,C15H26O2,pos_1_1proton1methanol,238.193280072,WKGPQOAMUAIBRO,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5272,3539,-1,,,,0.0,MS1_match,WKGPQOAMUAIBRO-FCNPYSRZSA-N,"InChI=1S/C15H26O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10-,11-,12+,14-,15+/m0/s1",C[C@H]1CC[C@@]2(O)C(C)(C)[C@H]3C[C@@H]1[C@]2(C)C[C@H]3O,C15H26O2,pos_1_1proton1methanol,238.193280072,WKGPQOAMUAIBRO,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5273,3539,-1,,,,0.0,MS1_match,ZADVMZUKWWMSLQ-PVZBEVCSSA-N,"InChI=1S/C15H26O2/c1-9-7-12(16)13-11(9)8-10-5-6-15(13,4)17-14(10,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10+,11-,12-,13+,15-/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@@H]1CC[C@@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,ZADVMZUKWWMSLQ,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 5274,3539,-1,,,,0.0,MS1_match,SJKFIHGLULSUCA-SNPRPXQTSA-N,"InChI=1S/C15H26O2/c1-11(2)12-6-8-15(10-16)7-4-5-13(17)14(15,3)9-12/h11-12,16H,4-10H2,1-3H3/t12-,14+,15+/m1/s1",CC(C)[C@@H]1CC[C@]2(CO)CCCC(=O)[C@]2(C)C1,C15H26O2,pos_1_1proton1methanol,238.193280072,SJKFIHGLULSUCA,Terpenoids,Sesquiterpenoids,Valerane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5275,3539,-1,,,,0.0,MS1_match,SJKFIHGLULSUCA-SNPRPXQTSA-N,"InChI=1S/C15H26O2/c1-11(2)12-6-8-15(10-16)7-4-5-13(17)14(15,3)9-12/h11-12,16H,4-10H2,1-3H3/t12-,14+,15+/m1/s1",CC(C)[C@@H]1CC[C@]2(CO)CCCC(=O)[C@]2(C)C1,C15H26O2,pos_1_1proton1methanol,238.193280072,SJKFIHGLULSUCA,Terpenoids,Sesquiterpenoids,Valerane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 5276,3539,-1,,,,0.0,MS1_match,XSCKUUHHFRRUMW-RBSFLKMASA-N,"InChI=1S/C15H26O2/c1-11(2)6-5-7-13(4)15(17)9-8-12(3)10-14(15)16/h6,10,13-14,16-17H,5,7-9H2,1-4H3/t13-,14-,15-/m1/s1",CC(C)=CCC[C@@H](C)[C@]1(O)CCC(C)=C[C@H]1O,C15H26O2,pos_1_1proton1methanol,238.193280072,XSCKUUHHFRRUMW,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5277,3539,-1,,,,0.0,MS1_match,XSCKUUHHFRRUMW-RBSFLKMASA-N,"InChI=1S/C15H26O2/c1-11(2)6-5-7-13(4)15(17)9-8-12(3)10-14(15)16/h6,10,13-14,16-17H,5,7-9H2,1-4H3/t13-,14-,15-/m1/s1",CC(C)=CCC[C@@H](C)[C@]1(O)CCC(C)=C[C@H]1O,C15H26O2,pos_1_1proton1methanol,238.193280072,XSCKUUHHFRRUMW,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 5278,3539,-1,,,,0.0,MS1_match,UTNQUNGFEKWBQT-HHHGZCDHSA-N,"InChI=1S/C15H26O2/c1-10(2)11-8-14(4)13(3)6-5-7-15(14,16)17-12(11)9-13/h10-12,16H,5-9H2,1-4H3/t11-,12-,13+,14-,15?/m1/s1",CC(C)[C@H]1C[C@@]2(C)C3(O)CCC[C@@]2(C)C[C@H]1O3,C15H26O2,pos_1_1proton1methanol,238.193280072,UTNQUNGFEKWBQT,Terpenoids,Sesquiterpenoids,Valerane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5279,3539,-1,,,,0.0,MS1_match,WKGPQOAMUAIBRO-FCNPYSRZSA-N,"InChI=1S/C15H26O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10-,11-,12+,14-,15+/m0/s1",C[C@H]1CC[C@@]2(O)C(C)(C)[C@H]3C[C@@H]1[C@]2(C)C[C@H]3O,C15H26O2,pos_1_1proton1methanol,238.193280072,WKGPQOAMUAIBRO,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 5280,3539,-1,,,,0.0,MS1_match,SCYYILSHQOYTTA-CGNPOWQISA-N,"InChI=1S/C15H26O2/c1-9-5-6-11-10(9)7-12-13(16)8-15(11,4)17-14(12,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10-,11-,12+,13+,15+/m1/s1",C[C@@H]1CC[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O2,pos_1_1proton1methanol,238.193280072,SCYYILSHQOYTTA,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5281,3538,377,Polyketides,Aromatic polyketides,Catechols with side chains,0.3816006,ISDB,QSAZGMNPQJKWDO-UHFFFAOYSA-N,"InChI=1S/C24H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-19-23(25)21-24(20-22)26-2/h4-5,7-8,10-11,19-21,25H,3,6,9,12-18H2,1-2H3",CCC=CCC=CCC=CCCCCCCCc1cc(O)cc(OC)c1,C24H36O2,,356.271530392,QSAZGMNPQJKWDO,Polyketides,Aromatic polyketides,Catechols with side chains,Omphalanthus filiformis,703702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Jungermanniopsida'],['Porellales'],['Lejeuneaceae'],['Unknown'],['Omphalanthus'],['Omphalanthus filiformis'],3,3,6.0264023542404175 5282,3538,377,Polyketides,Aromatic polyketides,Catechols with side chains,0.3816006,ISDB,QSAZGMNPQJKWDO-YSTUJMKBSA-N,"InChI=1S/C24H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-19-23(25)21-24(20-22)26-2/h4-5,7-8,10-11,19-21,25H,3,6,9,12-18H2,1-2H3/b5-4-,8-7-,11-10-",CC/C=C\C/C=C\C/C=C\CCCCCCCc1cc(O)cc(OC)c1,C24H36O2,,356.271530392,QSAZGMNPQJKWDO,Polyketides,Aromatic polyketides,Catechols with side chains,Cheilolejeunea filiformis,703702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Jungermanniopsida'],['Porellales'],['Lejeuneaceae'],['Unknown'],['Omphalanthus'],['Omphalanthus filiformis'],3,3,6.0264023542404175 5283,3536,-1,,,,0.25910777,ISDB,NSIGTFXHCFDUIY-XKVYUHEQSA-N,"InChI=1S/C32H39NO7/c1-19(2)7-5-8-20(3)9-6-14-32(4)28(36)17-24-27(35)16-23-25(29(24)40-32)18-33(30(23)37)26(31(38)39)15-21-10-12-22(34)13-11-21/h7,9-13,16,26,28,34-36H,5-6,8,14-15,17-18H2,1-4H3,(H,38,39)/t26-,28-,32-/m0/s1",CC(C)=CCCC(C)=CCC[C@]1(C)Oc2c(c(O)cc3c2CN([C@@H](Cc2ccc(O)cc2)C(=O)O)C3=O)C[C@@H]1O,C32H39NO7,,549.272652588,NSIGTFXHCFDUIY,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,Stachybotrys microspora,165548.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Unknown'],['Unknown'],['Stachybotrys'],['Stachybotrys microspora'],1,0,2.036431074142456 5284,3536,-1,,,,0.25910777,ISDB,NSIGTFXHCFDUIY-XKVYUHEQSA-N,"InChI=1S/C32H39NO7/c1-19(2)7-5-8-20(3)9-6-14-32(4)28(36)17-24-27(35)16-23-25(29(24)40-32)18-33(30(23)37)26(31(38)39)15-21-10-12-22(34)13-11-21/h7,9-13,16,26,28,34-36H,5-6,8,14-15,17-18H2,1-4H3,(H,38,39)/t26-,28-,32-/m0/s1",CC(C)=CCCC(C)=CCC[C@]1(C)Oc2c(c(O)cc3c2CN([C@@H](Cc2ccc(O)cc2)C(=O)O)C3=O)C[C@@H]1O,C32H39NO7,,549.272652588,NSIGTFXHCFDUIY,Alkaloids,Pseudoalkaloids,Isoindole alkaloids,Stachybotrys microsporus,165548.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Unknown'],['Unknown'],['Stachybotrys'],['Stachybotrys microspora'],1,0,2.036431074142456 5285,3532,-1,,,,0.0,MS1_match,AOGQPLXWSUTHQB-UHFFFAOYSA-N,"InChI=1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3",CCCCCCOC(C)=O,C8H16O2,pos_2MH,144.115029752,AOGQPLXWSUTHQB,Fatty acids,Fatty esters,Wax monoesters,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5286,3529,-1,,,,0.0,MS1_match,HITLMPHPGUZLGI-FDBLAFQCSA-N,"InChI=1S/C20H30O4/c1-18-7-3-8-19(2,17(23)24)14(18)6-9-20-10-12(4-5-15(18)20)13(11-20)16(21)22/h12-15H,3-11H2,1-2H3,(H,21,22)(H,23,24)/t12-,13-,14+,15+,18-,19-,20+/m1/s1",C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@H](C(=O)O)C3,C20H30O4,pos_2MH,334.21440943999994,HITLMPHPGUZLGI,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 5287,3529,-1,,,,0.0,MS1_match,HITLMPHPGUZLGI-FDBLAFQCSA-N,"InChI=1S/C20H30O4/c1-18-7-3-8-19(2,17(23)24)14(18)6-9-20-10-12(4-5-15(18)20)13(11-20)16(21)22/h12-15H,3-11H2,1-2H3,(H,21,22)(H,23,24)/t12-,13-,14+,15+,18-,19-,20+/m1/s1",C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@H](C(=O)O)C3,C20H30O4,pos_2MH,334.21440943999994,HITLMPHPGUZLGI,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 5288,3529,-1,,,,0.0,MS1_match,FKVGKCKPWUXRCC-NYRONZRESA-N,"InChI=1S/C20H30O4/c1-16-6-3-7-19(12-24-15(16)21)14(16)5-8-18-10-13(17(2,22)11-18)4-9-20(18,19)23/h13-14,22-23H,3-12H2,1-2H3/t13-,14-,16-,17-,18+,19+,20+/m1/s1",C[C@]12CCC[C@]3(COC1=O)[C@@H]2CC[C@@]12C[C@@H](CC[C@]13O)[C@](C)(O)C2,C20H30O4,pos_2MH,334.21440944,FKVGKCKPWUXRCC,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 5289,3529,-1,,,,0.0,MS1_match,YCARJLZQBWVWFW-MRFFXTKBSA-N,"InChI=1S/C20H30O4/c1-17(2)8-6-9-19(5)13(17)7-10-20(12-15(21)18(3,4)23)14(19)11-16(22)24-20/h11,13,23H,6-10,12H2,1-5H3/t13-,19-,20-/m0/s1",CC(C)(O)C(=O)C[C@@]12CC[C@H]3C(C)(C)CCC[C@]3(C)C1=CC(=O)O2,C20H30O4,pos_2MH,334.21440944,YCARJLZQBWVWFW,Terpenoids,Diterpenoids,Norlabdane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 5290,3529,-1,,,,0.0,MS1_match,YCARJLZQBWVWFW-MRFFXTKBSA-N,"InChI=1S/C20H30O4/c1-17(2)8-6-9-19(5)13(17)7-10-20(12-15(21)18(3,4)23)14(19)11-16(22)24-20/h11,13,23H,6-10,12H2,1-5H3/t13-,19-,20-/m0/s1",CC(C)(O)C(=O)C[C@@]12CC[C@H]3C(C)(C)CCC[C@]3(C)C1=CC(=O)O2,C20H30O4,pos_2MH,334.21440944,YCARJLZQBWVWFW,Terpenoids,Diterpenoids,Norlabdane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,0,6.0 5291,3527,-1,,,,0.35828844,ISDB,YEMWKQFIGUCZFS-PBYGLRBLSA-N,"InChI=1S/C28H28O13/c1-36-20-12-16(4-8-18(20)30)6-10-24(33)39-21-13-28(27(35)37-2)40-22(26(41-28)25(21)34)14-38-23(32)9-5-15-3-7-17(29)19(31)11-15/h3-12,21-22,25-26,29-31,34H,13-14H2,1-2H3/b9-5+,10-6+/t21-,22-,25-,26-,28+/m1/s1",COC(=O)[C@]12C[C@@H](OC(=O)/C=C/c3ccc(O)c(OC)c3)[C@@H](O)[C@H](O1)[C@@H](COC(=O)/C=C/c1ccc(O)c(O)c1)O2,C28H28O13,,572.1529909559999,YEMWKQFIGUCZFS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Erigeron canadensis,1008406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Erigeron'],['Erigeron canadensis'],4,0,5.433153748512268 5292,3527,-1,,,,0.35828844,ISDB,YEMWKQFIGUCZFS-PBYGLRBLSA-N,"InChI=1S/C28H28O13/c1-36-20-12-16(4-8-18(20)30)6-10-24(33)39-21-13-28(27(35)37-2)40-22(26(41-28)25(21)34)14-38-23(32)9-5-15-3-7-17(29)19(31)11-15/h3-12,21-22,25-26,29-31,34H,13-14H2,1-2H3/b9-5+,10-6+/t21-,22-,25-,26-,28+/m1/s1",COC(=O)[C@]12C[C@@H](OC(=O)/C=C/c3ccc(O)c(OC)c3)[C@@H](O)[C@H](O1)[C@@H](COC(=O)/C=C/c1ccc(O)c(O)c1)O2,C28H28O13,,572.1529909559999,YEMWKQFIGUCZFS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Conyza canadensis,1008406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Erigeron'],['Erigeron canadensis'],4,0,5.433153748512268 5293,3525,-1,,,,0.36024714,ISDB,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],0,0,1.440988540649414 5294,3525,-1,,,,0.36024714,ISDB,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],0,0,1.440988540649414 5295,3525,-1,,,,0.36024714,ISDB,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],0,0,1.440988540649414 5296,3525,-1,,,,0.36024714,ISDB,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],0,0,1.440988540649414 5297,3525,-1,,,,0.36024714,ISDB,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],0,0,1.440988540649414 5298,3522,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.20551117,ISDB,,,,,,,VSEIDKRSJSYZRQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8220446705818176 5299,3519,921,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,0.44510326,ISDB,FEBNTWHYQKGEIQ-JWRGBUJQSA-N,"InChI=1S/C15H22O2/c1-9-4-6-12(8-11(3)15(16)17)14-10(2)5-7-13(9)14/h8-9,12-13H,4-7H2,1-3H3,(H,16,17)/b11-8-/t9-,12+,13-/m1/s1",CC1=C2[C@H](/C=C(/C)C(=O)O)CC[C@@H](C)[C@H]2CC1,C15H22O2,,234.161979944,FEBNTWHYQKGEIQ,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.780413031578064 5300,3519,921,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,0.44510326,ISDB,FEBNTWHYQKGEIQ-JWRGBUJQSA-N,"InChI=1S/C15H22O2/c1-9-4-6-12(8-11(3)15(16)17)14-10(2)5-7-13(9)14/h8-9,12-13H,4-7H2,1-3H3,(H,16,17)/b11-8-/t9-,12+,13-/m1/s1",CC1=C2[C@H](/C=C(/C)C(=O)O)CC[C@@H](C)[C@H]2CC1,C15H22O2,,234.161979944,FEBNTWHYQKGEIQ,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,2,8.780413031578064 5301,3518,-1,,,,0.0,MS1_match,YEUIANWBIIZWTM-KORLLVGLSA-N,"InChI=1S/C30H46O4/c1-16(2)17-9-10-20-28(6)14-19(32)24-25(29(28,7)15-23(34)30(17,20)8)18(31)13-21-26(3,4)22(33)11-12-27(21,24)5/h16-17,20-23,33-34H,9-15H2,1-8H3/t17-,20+,21+,22-,23-,27+,28+,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=C(C(=O)C[C@@]21C)[C@@]1(C)CC[C@@H](O)C(C)(C)[C@@H]1CC3=O,C30H46O4,pos_1_1proton1acetonitrile,470.339609952,YEUIANWBIIZWTM,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 5302,3516,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZAGGPLANHIGDAL-LIVJIHFKSA-N,"InChI=1S/C15H19NO10/c1-24-11(20)4-7(2-3-10(18)19)8(5-16)25-15-14(23)13(22)12(21)9(6-17)26-15/h2-3,9,12-15,17,21-23H,4,6H2,1H3,(H,18,19)/b3-2+,8-7+/t9-,12+,13+,14+,15-/m0/s1",COC(=O)CC(/C=C/C(=O)O)=C(\C#N)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C15H19NO10,pos_1_1proton,373.100895808,ZAGGPLANHIGDAL,,,,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 5303,3516,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZAGGPLANHIGDAL-LIVJIHFKSA-N,"InChI=1S/C15H19NO10/c1-24-11(20)4-7(2-3-10(18)19)8(5-16)25-15-14(23)13(22)12(21)9(6-17)26-15/h2-3,9,12-15,17,21-23H,4,6H2,1H3,(H,18,19)/b3-2+,8-7+/t9-,12+,13+,14+,15-/m0/s1",COC(=O)CC(/C=C/C(=O)O)=C(\C#N)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C15H19NO10,pos_1_1proton,373.100895808,ZAGGPLANHIGDAL,,,,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 5304,3515,728,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.61545694,ISDB,MLKFESWUFLKYRE-UHFFFAOYSA-N,"InChI=1S/C13H17NO5/c1-19-13(18)10-6-14(4-5-15)12(17)11-8(7-16)2-3-9(10)11/h2,6,9,11,15-16H,3-5,7H2,1H3",COC(=O)C1=CN(CCO)C(=O)C2C(CO)=CCC12,C13H17NO5,,267.110672644,MLKFESWUFLKYRE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Gardenia jasminoides,919367.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Gardenieae'],['Gardenia'],['Gardenia jasminoides'],4,3,7.961827754974365 5305,3511,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,IPRPPFIAVHPVJH-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2",O=CCc1ccc(O)cc1,C8H8O2,pos_1_1proton2acetonitrile,136.052429496,IPRPPFIAVHPVJH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,1,8.5 5306,3510,446,Polyketides,Steroids,Stigmastane steroids,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,3,9.5 5307,3510,446,Polyketides,Steroids,Stigmastane steroids,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 5308,3510,446,Polyketides,Steroids,Stigmastane steroids,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,3,9.5 5309,3510,446,Polyketides,Steroids,Stigmastane steroids,0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis montana,970477.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis montana'],8,3,9.5 5310,3510,446,Polyketides,Steroids,Stigmastane steroids,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 5311,3510,446,Polyketides,Steroids,Stigmastane steroids,0.0,MS1_match,NPJICTMALKLTFW-UHFFFAOYSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 5312,3506,-1,,,,0.0,MS1_match,GUZAIURHRDPBKE-HIEJAJBWSA-N,"InChI=1S/C30H46O3/c1-17(2)18-9-12-22-29(18,7)25(33)16-28(6)19-10-11-21-26(3,4)23(31)13-14-27(21,5)20(19)15-24(32)30(22,28)8/h10,15,17-18,21-23,25,31,33H,9,11-14,16H2,1-8H3/t18-,21+,22-,23-,25-,27-,28-,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC(=O)[C@@]21C,C30H46O3,pos_1_sodium,454.344695332,GUZAIURHRDPBKE,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 5313,3506,-1,,,,0.0,MS1_match,SLJTWDNVZKIDAU-SVAFSPIFSA-N,"InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O3,pos_1_sodium,454.3446953319999,SLJTWDNVZKIDAU,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,0,7.0 5314,3506,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-UHFFFAOYSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3",CC12CC(OC1=O)C1(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C1C2,C30H46O3,pos_1_sodium,454.344695332,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,0,7.0 5315,3506,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-YLXTXNMFSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3/t19-,20-,21+,22-,23-,26-,27+,28-,29+,30+/m0/s1",CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3CC=C4[C@@H]5C[C@@]6(C)C[C@H](OC6=O)[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12,C30H46O3,pos_1_sodium,454.3446953319999,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 5316,3506,-1,,,,0.0,MS1_match,SLJTWDNVZKIDAU-SVAFSPIFSA-N,"InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O3,pos_1_sodium,454.3446953319999,SLJTWDNVZKIDAU,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,0,7.0 5317,3506,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-UHFFFAOYSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3",CC12CC(OC1=O)C1(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C1C2,C30H46O3,pos_1_sodium,454.344695332,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,0,7.0 5318,3506,-1,,,,0.0,MS1_match,HHQJBWYXBWOFJY-YLXTXNMFSA-N,"InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3/t19-,20-,21+,22-,23-,26-,27+,28-,29+,30+/m0/s1",CC1(C)[C@@H](O)CC[C@]2(C)[C@H]3CC=C4[C@@H]5C[C@@]6(C)C[C@H](OC6=O)[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12,C30H46O3,pos_1_sodium,454.3446953319999,HHQJBWYXBWOFJY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 5319,3504,527,Terpenoids,Diterpenoids,Menthane monoterpenoids,0.39196888,ISDB,QWTSMPKFTJSMFD-AZUAARDMSA-N,"InChI=1S/C20H26O/c1-13-14-6-7-18-19(2,3)9-5-10-20(18,4)16(14)12-17-15(13)8-11-21-17/h8,11-12,18H,5-7,9-10H2,1-4H3/t18-,20+/m0/s1",Cc1c2c(cc3occc13)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2,C20H26O,,282.198365452,QWTSMPKFTJSMFD,Terpenoids,Diterpenoids,Cassane diterpenoids,Guilandina bonduc,72917.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Guilandina'],['Guilandina bonduc'],4,2,6.567875504493713 5320,3504,527,Terpenoids,Diterpenoids,Menthane monoterpenoids,0.39196888,ISDB,QWTSMPKFTJSMFD-AZUAARDMSA-N,"InChI=1S/C20H26O/c1-13-14-6-7-18-19(2,3)9-5-10-20(18,4)16(14)12-17-15(13)8-11-21-17/h8,11-12,18H,5-7,9-10H2,1-4H3/t18-,20+/m0/s1",Cc1c2c(cc3occc13)[C@@]1(C)CCCC(C)(C)[C@@H]1CC2,C20H26O,,282.198365452,QWTSMPKFTJSMFD,Terpenoids,Diterpenoids,Cassane diterpenoids,Caesalpinia crista,656774.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Guilandina'],['Guilandina crista'],4,2,6.567875504493713 5321,3500,-1,,,,0.4838767,ISDB,,,,,,,YDVDXUYJFQLPEG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.935506820678711 5322,3499,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.76615214,ISDB,WCVUIHQUPRXYKT-RGCIIANRSA-N,"InChI=1S/C18H24O12/c1-8-16(9(19)3-4-27-8)30-17-15(25)14(24)13(23)10(29-17)7-28-12(22)6-18(2,26)5-11(20)21/h3-4,10,13-15,17,23-26H,5-7H2,1-2H3,(H,20,21)/t10-,13-,14+,15-,17+,18?/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](COC(=O)CC(C)(O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]1O,C18H24O12,,432.126776208,WCVUIHQUPRXYKT,,,,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,7.064608573913574 5323,3499,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.76615214,ISDB,WCVUIHQUPRXYKT-GWQNOCNDSA-N,"InChI=1S/C18H24O12/c1-8-16(9(19)3-4-27-8)30-17-15(25)14(24)13(23)10(29-17)7-28-12(22)6-18(2,26)5-11(20)21/h3-4,10,13-15,17,23-26H,5-7H2,1-2H3,(H,20,21)/t10-,13-,14+,15-,17+,18+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](COC(=O)C[C@@](C)(O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]1O,C18H24O12,,432.126776208,WCVUIHQUPRXYKT,,,,Helichrysum arenarium,338550.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Helichrysum'],['Helichrysum arenarium'],4,0,7.064608573913574 5324,3499,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.76615214,ISDB,WCVUIHQUPRXYKT-GWQNOCNDSA-N,"InChI=1S/C18H24O12/c1-8-16(9(19)3-4-27-8)30-17-15(25)14(24)13(23)10(29-17)7-28-12(22)6-18(2,26)5-11(20)21/h3-4,10,13-15,17,23-26H,5-7H2,1-2H3,(H,20,21)/t10-,13-,14+,15-,17+,18+/m1/s1",Cc1occc(=O)c1O[C@@H]1O[C@H](COC(=O)C[C@@](C)(O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]1O,C18H24O12,,432.126776208,WCVUIHQUPRXYKT,,,,Glycyrrhiza glabra,554264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza glabra'],4,0,7.064608573913574 5325,3499,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.76615214,ISDB,WCVUIHQUPRXYKT-UHFFFAOYSA-N,"InChI=1S/C18H24O12/c1-8-16(9(19)3-4-27-8)30-17-15(25)14(24)13(23)10(29-17)7-28-12(22)6-18(2,26)5-11(20)21/h3-4,10,13-15,17,23-26H,5-7H2,1-2H3,(H,20,21)",Cc1occc(=O)c1OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,C18H24O12,,432.126776208,WCVUIHQUPRXYKT,,,,Genista numidica,1022926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Genisteae'],['Genista'],['Genista numidica'],4,0,7.064608573913574 5326,3499,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.76615214,ISDB,WCVUIHQUPRXYKT-UHFFFAOYSA-N,"InChI=1S/C18H24O12/c1-8-16(9(19)3-4-27-8)30-17-15(25)14(24)13(23)10(29-17)7-28-12(22)6-18(2,26)5-11(20)21/h3-4,10,13-15,17,23-26H,5-7H2,1-2H3,(H,20,21)",Cc1occc(=O)c1OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,C18H24O12,,432.126776208,WCVUIHQUPRXYKT,,,,Ononis arvensis,1072859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis arvensis'],4,0,7.064608573913574 5327,3499,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.76615214,ISDB,WCVUIHQUPRXYKT-UHFFFAOYSA-N,"InChI=1S/C18H24O12/c1-8-16(9(19)3-4-27-8)30-17-15(25)14(24)13(23)10(29-17)7-28-12(22)6-18(2,26)5-11(20)21/h3-4,10,13-15,17,23-26H,5-7H2,1-2H3,(H,20,21)",Cc1occc(=O)c1OC1OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C1O,C18H24O12,,432.126776208,WCVUIHQUPRXYKT,,,,Herniaria glabra,300043.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Paronychieae'],['Herniaria'],['Herniaria glabra'],4,0,7.064608573913574 5328,3498,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NMICSFNNFDNGEL-UHFFFAOYSA-N,"InChI=1S/C25H20O9/c1-31-20-7-13(2-4-15(20)28)25-23(11-26)33-21-6-12(3-5-18(21)34-25)19-10-17(30)24-16(29)8-14(27)9-22(24)32-19/h2-10,23,25-29H,11H2,1H3",COc1cc(C2Oc3ccc(-c4cc(=O)c5c(O)cc(O)cc5o4)cc3OC2CO)ccc1O,C25H20O9,pos_1_1proton1methanol,464.11073222,NMICSFNNFDNGEL,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5329,3498,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NMICSFNNFDNGEL-UHFFFAOYSA-N,"InChI=1S/C25H20O9/c1-31-20-7-13(2-4-15(20)28)25-23(11-26)33-21-6-12(3-5-18(21)34-25)19-10-17(30)24-16(29)8-14(27)9-22(24)32-19/h2-10,23,25-29H,11H2,1H3",COc1cc(C2Oc3ccc(-c4cc(=O)c5c(O)cc(O)cc5o4)cc3OC2CO)ccc1O,C25H20O9,pos_1_1proton1methanol,464.11073222,NMICSFNNFDNGEL,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 5330,3497,-1,,,,0.3125636,ISDB,,,,,,,SJOVPRHUFSKVFO,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2502543926239014 5331,3492,728,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DKGYTSKPMLWLEI-FIZOKRMRSA-N,"InChI=1S/C10H14O4/c1-5-2-3-6-7(9(11)12)4-14-10(13)8(5)6/h4-6,8,10,13H,2-3H2,1H3,(H,11,12)/t5-,6+,8+,10+/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O)[C@@H]21,C10H14O4,pos_1_1proton1acetonitrile,198.089208928,DKGYTSKPMLWLEI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5332,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-STUKLFKUSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3/t25-,30-,32+,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C43H68O10,,744.4812483759999,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Corymbia citriodora,409369.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Myrtaceae'],['Eucalypteae'],['Corymbia'],['Corymbia citriodora'],4,1,5.694952726364136 5333,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-STUKLFKUSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3/t25-,30-,32+,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C43H68O10,,744.4812483759999,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Rosa transmorrisonensis,3905058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa transmorrisonensis'],4,1,5.694952726364136 5334,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-UHFFFAOYSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3",CCC(CCC(C)C1CCC2C3CC=C4CC(OC5OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C5OC(C)=O)CCC4(C)C3CCC12C)C(C)C,C43H68O10,,744.481248376,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Picramnia antidesma,376693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Picramniales'],['Picramniaceae'],['Unknown'],['Picramnia'],['Picramnia antidesma'],4,1,5.694952726364136 5335,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-STUKLFKUSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3/t25-,30-,32+,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C43H68O10,,744.4812483759999,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Dorstenia mannii,923990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Dorstenia'],['Dorstenia mannii'],4,1,5.694952726364136 5336,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-STUKLFKUSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3/t25-,30-,32+,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C43H68O10,,744.4812483759999,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Iryanthera lancifolia,111996.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Myristicaceae'],['Unknown'],['Iryanthera'],['Iryanthera lancifolia'],4,1,5.694952726364136 5337,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-STUKLFKUSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3/t25-,30-,32+,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C43H68O10,,744.4812483759999,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Eucalyptus globulus,847929.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Myrtaceae'],['Eucalypteae'],['Eucalyptus'],['Eucalyptus globulus'],4,1,5.694952726364136 5338,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-STUKLFKUSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3/t25-,30-,32+,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C43H68O10,,744.4812483759999,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Polyalthia longifolia,204189.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Monoon'],['Monoon longifolium'],4,1,5.694952726364136 5339,3491,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.29873818,ISDB,JCNOHQSTTZAMOE-STUKLFKUSA-N,"InChI=1S/C43H68O10/c1-11-30(24(2)3)13-12-25(4)34-16-17-35-33-15-14-31-22-32(18-20-42(31,9)36(33)19-21-43(34,35)10)52-41-40(51-29(8)47)39(50-28(7)46)38(49-27(6)45)37(53-41)23-48-26(5)44/h14,24-25,30,32-41H,11-13,15-23H2,1-10H3/t25-,30-,32+,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C43H68O10,,744.4812483759999,JCNOHQSTTZAMOE,Terpenoids,Steroids,Cholestane steroids,Gymnosporia diversifolia,420497.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia diversifolia'],4,1,5.694952726364136 5340,3486,-1,,,,0.23593277,ISDB,QVUGVMYAQOTVMJ-OALUTQOASA-N,"InChI=1S/C21H21N3O3/c1-24-19(10-13-6-8-15(25)9-7-13)20(26)23-18(21(24)27)11-14-12-22-17-5-3-2-4-16(14)17/h2-9,12,18-19,22,25H,10-11H2,1H3,(H,23,26)/t18-,19-/m0/s1",CN1C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]1Cc1ccc(O)cc1,C21H21N3O3,,363.158291532,QVUGVMYAQOTVMJ,Amino acids and Peptides,Small peptides,Dipeptides,Aspergillus,550772.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Unknown'],1,0,1.9437310695648193 5341,3485,-1,,,,0.5598864,ISDB,ABGLVXROVAEWNL-WDSKDSINSA-N,"InChI=1S/C7H13NO3/c1-11-5-2-3-8-6(4-5)7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10)/t5-,6-/m0/s1",CO[C@H]1CCN[C@H](C(=O)O)C1,C7H13NO3,,159.089543276,ABGLVXROVAEWNL,Amino acids and Peptides,Small peptides,Aminoacids,Inga oerstediana,634780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Inga'],['Inga oerstediana'],4,0,6.239545583724976 5342,3485,-1,,,,0.5598864,ISDB,ABGLVXROVAEWNL-WDSKDSINSA-N,"InChI=1S/C7H13NO3/c1-11-5-2-3-8-6(4-5)7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10)/t5-,6-/m0/s1",CO[C@H]1CCN[C@H](C(=O)O)C1,C7H13NO3,,159.089543276,ABGLVXROVAEWNL,Amino acids and Peptides,Small peptides,Aminoacids,Inga longispica,3918971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Inga'],['Inga longispica'],4,0,6.239545583724976 5343,3485,-1,,,,0.5598864,ISDB,ABGLVXROVAEWNL-WDSKDSINSA-N,"InChI=1S/C7H13NO3/c1-11-5-2-3-8-6(4-5)7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10)/t5-,6-/m0/s1",CO[C@H]1CCN[C@H](C(=O)O)C1,C7H13NO3,,159.089543276,ABGLVXROVAEWNL,Amino acids and Peptides,Small peptides,Aminoacids,Inga sierrae,667459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Inga'],['Inga sierrae'],4,0,6.239545583724976 5344,3485,-1,,,,0.5598864,ISDB,ABGLVXROVAEWNL-WDSKDSINSA-N,"InChI=1S/C7H13NO3/c1-11-5-2-3-8-6(4-5)7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10)/t5-,6-/m0/s1",CO[C@H]1CCN[C@H](C(=O)O)C1,C7H13NO3,,159.089543276,ABGLVXROVAEWNL,Amino acids and Peptides,Small peptides,Aminoacids,Inga paterno,3919072.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Inga'],['Inga paterno'],4,0,6.239545583724976 5345,3484,-1,,,,0.5028126,ISDB,MNOFWIGNEQZDMR-GSDPDGKRSA-N,"InChI=1S/C29H38O4/c1-17-7-8-20-18(2)24(31)22(30)15-21(20)19(17)9-10-29-23-16-28(6,25(32)33-29)14-13-27(23,5)12-11-26(29,3)4/h7-8,15,23,30-31H,9-14,16H2,1-6H3/t23-,27+,28-,29-/m1/s1",Cc1ccc2c(C)c(O)c(O)cc2c1CC[C@]12OC(=O)[C@]3(C)CC[C@](C)(CCC1(C)C)[C@H]2C3,C29H38O4,,450.277009696,MNOFWIGNEQZDMR,Terpenoids,Diterpenoids,Labdane diterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],4,0,6.0112504959106445 5346,3483,1043,Fatty acids,Fatty acyls,Fatty alcohols,0.21540405,ISDB,YJPSPAUZXUUWRY-SSBOKUKZSA-N,"InChI=1S/C29H60O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25-28(31)29(32)26-27(30)24-22-8-6-4-2/h27-32H,3-26H2,1-2H3/t27-,28+,29-/m1/s1",CCCCCCCCCCCCCCCCCCC[C@H](O)[C@H](O)C[C@H](O)CCCCCC,C29H60O3,,456.45424578,YJPSPAUZXUUWRY,Fatty acids,Fatty acyls,Fatty alcohols,Typha angustifolia,17923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Typhaceae'],['Unknown'],['Typha'],['Typha angustifolia'],4,3,6.3616161942481995 5347,3473,-1,,,,0.77286696,ISDB,,,,,,,MSPPBQWCHZVSDA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.09146785736084 5348,3471,-1,,,,0.0,MS1_match,SQWBLOVFMFTTHY-CUQQVVPFSA-N,"InChI=1S/C26H31NO13/c1-2-15-16(6-5-13-8-14(23(34)35)10-27(9-13)7-3-4-19(29)30)17(24(36)37)12-38-25(15)40-26-22(33)21(32)20(31)18(11-28)39-26/h2,5-6,8-10,12,15-16,18,20-22,25-26,28,31-33H,1,3-4,7,11H2,(H2-,29,30,34,35,36,37)/b6-5+/t15-,16+,18-,20-,21+,22-,25+,26+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1cc(C(=O)O)c[n+](CCCC(=O)O)c1,C26H31NO13,pos_1_1proton1acetonitrile,565.179540052,SQWBLOVFMFTTHY,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5349,3466,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,YGSBJLPWANWGED-HYXYOFMCSA-N,"InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_2_1proton1potassium,942.5188156560004,YGSBJLPWANWGED,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis tibetana,972666.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tibetana'],8,0,8.0 5350,3466,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,YGSBJLPWANWGED-HYXYOFMCSA-N,"InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_2_1proton1potassium,942.5188156560004,YGSBJLPWANWGED,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,0,8.0 5351,3466,286,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,YGSBJLPWANWGED-HYXYOFMCSA-N,"InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_2_1proton1potassium,942.5188156560004,YGSBJLPWANWGED,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis,964052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Unknown'],8,0,8.0 5352,3462,-1,,,,0.0,MS1_match,ZLGMGWPIAQVIEN-UQQFGYGUSA-N,"InChI=1S/C25H38O10/c1-13(2)7-18(27)34-20(15(5)6)22(29)31-10-16-11-32-23(35-19(28)8-14(3)4)21-24(16,30)9-17(26)25(21)12-33-25/h11,13-15,17,20-21,23,26,30H,7-10,12H2,1-6H3/t17-,20+,21-,23-,24-,25+/m0/s1",CC(C)CC(=O)O[C@@H]1OC=C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@H](O)[C@]3(CO3)[C@@H]12,C25H38O10,pos_1_1proton1methanol,498.246497416,ZLGMGWPIAQVIEN,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5353,3462,-1,,,,0.0,MS1_match,ZLGMGWPIAQVIEN-VELCPHELSA-N,"InChI=1S/C25H38O10/c1-13(2)7-18(27)34-20(15(5)6)22(29)31-10-16-11-32-23(35-19(28)8-14(3)4)21-24(16,30)9-17(26)25(21)12-33-25/h11,13-15,17,20-21,23,26,30H,7-10,12H2,1-6H3/t17-,20?,21-,23-,24+,25+/m0/s1",CC(C)CC(=O)OC(C(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]3(CO3)[C@@H](O)C[C@@]12O)C(C)C,C25H38O10,pos_1_1proton1methanol,498.246497416,ZLGMGWPIAQVIEN,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 5354,3461,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8016832,ISDB,REFJWTPEDVJJIY-UHFFFAOYSA-N,"InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H",O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O7,,302.04265266,REFJWTPEDVJJIY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],8,3,12.706732749938965 5355,3460,-1,,,,0.67393994,ISDB,JDVDGNAHTZMMBI-UHFFFAOYSA-N,"InChI=1S/C21H36O3/c1-5-7-8-9-10-11-12-13-14-15-16-19-17(3)20(22)18(6-2)21(23-4)24-19/h5-16H2,1-4H3",CCCCCCCCCCCCc1oc(OC)c(CC)c(=O)c1C,C21H36O3,,336.266445012,JDVDGNAHTZMMBI,Polyketides,Cyclic polyketides,4-pyrone derivatives,Podolepis rugata,24091.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Podolepis'],['Podolepis rugata'],4,0,6.6957597732543945 5356,3457,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.4327575,ISDB,BJIOGJUNALELMI-ONEGZZNKSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+",C/C=C/c1ccc(O)c(OC)c1,C10H12O2,,164.083729624,BJIOGJUNALELMI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,9.231029987335205 5357,3457,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.4327575,ISDB,BJIOGJUNALELMI-ONEGZZNKSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+",C/C=C/c1ccc(O)c(OC)c1,C10H12O2,,164.083729624,BJIOGJUNALELMI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,9.231029987335205 5358,3454,1254,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,0.41771606,ISDB,,,,,,,LGIKFBYSSJHCQR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.670864224433899 5359,3452,1459,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,0.21686122,ISDB,,,,,,,WISFBGZZZDIQKY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8674448728561401 5360,3450,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.24375997,ISDB,RGAZJYSRPZSBTF-GVVOHZSFSA-N,"InChI=1S/C40H52O2/c1-29(18-13-20-31(3)23-25-35-33(5)22-15-27-39(35,7)8)16-11-12-17-30(2)19-14-21-32(4)24-26-36-34(6)38(42)37(41)28-40(36,9)10/h11-14,16-21,23-26,28,41H,15,22,27H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,29-16+,30-17+,31-20+,32-21+",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)C(O)=CC2(C)C)C(C)(C)CCC1,C40H52O2,,564.396730904,RGAZJYSRPZSBTF,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Adonis annua,804994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis annua'],6,3,8.475039899349213 5361,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-YDYVGBNJSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7+,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Crotalaria emarginella,253602.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Crotalarieae'],['Crotalaria'],['Crotalaria emarginella'],4,3,8.44727373123169 5362,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-YDYVGBNJSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7+,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centaurium erythraea,732976.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Chironieae'],['Centaurium'],['Centaurium erythraea'],4,3,8.44727373123169 5363,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-NCZCWLEHSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9+,10-,11+,12-,13-,15+,16+/m0/s1",C[C@H]1CC[C@H]2C(C(=O)O)=CO[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]12,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nepeta cataria,830200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta cataria'],4,3,8.44727373123169 5364,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Pedicularis artselaeri,5536458.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Pedicularideae'],['Pedicularis'],['Pedicularis artselaeri'],4,3,8.44727373123169 5365,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-YDYVGBNJSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7+,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Uncaria tomentosa,204985.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Uncaria'],['Uncaria tomentosa'],4,3,8.44727373123169 5366,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-YDYVGBNJSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7+,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Verbena officinalis,472462.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Verbenaceae'],['Verbeneae'],['Verbena'],['Verbena officinalis'],4,3,8.44727373123169 5367,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plantago webbii,959597.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Plantagineae'],['Plantago'],['Plantago webbii'],4,3,8.44727373123169 5368,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Argylia radiata,6079969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Unknown'],['Argylia'],['Argylia radiata'],4,3,8.44727373123169 5369,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Pedicularis verticillata,980478.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Pedicularideae'],['Pedicularis'],['Pedicularis verticillata'],4,3,8.44727373123169 5370,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-MDIWZKTHSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9+,10-,11+,12-,13+,15+,16-/m0/s1",C[C@H]1CC[C@H]2C(C(=O)O)=CO[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nepeta italica,815544.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta italica'],4,3,8.44727373123169 5371,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Leonurus persicus,6081039.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Leonureae'],['Leonurus'],['Leonurus persicus'],4,3,8.44727373123169 5372,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Cistanche phelypaea,675210.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Orobancheae'],['Cistanche'],['Cistanche phelypaea'],4,3,8.44727373123169 5373,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Cistanche tubulosa,368050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Orobancheae'],['Cistanche'],['Cistanche tubulosa'],4,3,8.44727373123169 5374,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-MDIWZKTHSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9+,10-,11+,12-,13+,15+,16-/m0/s1",C[C@H]1CC[C@H]2C(C(=O)O)=CO[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nepeta caesarea,6082674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta caesarea'],4,3,8.44727373123169 5375,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Scyphiphora hydrophylacea,558798.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Scyphiphoreae'],['Scyphiphora'],['Scyphiphora hydrophyllacea'],4,3,8.44727373123169 5376,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Scyphiphora hydrophyllacea,558798.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Scyphiphoreae'],['Scyphiphora'],['Scyphiphora hydrophyllacea'],4,3,8.44727373123169 5377,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Pedicularis kansuensis,388725.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Pedicularideae'],['Pedicularis'],['Pedicularis kansuensis'],4,3,8.44727373123169 5378,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Boschniakia rossica,722922.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Orobancheae'],['Boschniakia'],['Boschniakia rossica'],4,3,8.44727373123169 5379,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-PKUPRILXSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9-,10-,11-,12+,13-,15+,16+/m1/s1",C[C@@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C16H24O9,,360.1420323479999,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Incarvillea delavayi,1066484.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Tecomeae'],['Incarvillea'],['Incarvillea delavayi'],4,3,8.44727373123169 5380,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-UHFFFAOYSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)",CC1CCC2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Incarvillea diffusa,591883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Tecomeae'],['Incarvillea'],['Incarvillea arguta'],4,3,8.44727373123169 5381,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-UHFFFAOYSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)",CC1CCC2C(C(=O)O)=COC(OC3OC(CO)C(O)C(O)C3O)C12,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Incarvillea arguta,591883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Tecomeae'],['Incarvillea'],['Incarvillea arguta'],4,3,8.44727373123169 5382,3447,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.73681843,ISDB,DSXFHNSGLYXPNG-MDIWZKTHSA-N,"InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6-,7-,9+,10-,11+,12-,13+,15+,16-/m0/s1",C[C@H]1CC[C@H]2C(C(=O)O)=CO[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12,C16H24O9,,360.142032348,DSXFHNSGLYXPNG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nepeta grandiflora,304980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta grandiflora'],4,3,8.44727373123169 5383,3440,-1,,,,0.0,MS1_match,ZHKYTTFZXBSTEE-UHFFFAOYSA-N,"InChI=1S/C10H18O4/c1-6(4-11)7-3-9(13)10(2,14)8(7)5-12/h7-9,11-14H,1,3-5H2,2H3",C=C(CO)C1CC(O)C(C)(O)C1CO,C10H18O4,pos_1_1proton1acetonitrile,202.120509056,ZHKYTTFZXBSTEE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5384,3440,-1,,,,0.0,MS1_match,ZHKYTTFZXBSTEE-KATARQTJSA-N,"InChI=1S/C10H18O4/c1-6(4-11)7-3-9(13)10(2,14)8(7)5-12/h7-9,11-14H,1,3-5H2,2H3/t7-,8+,9+,10+/m1/s1",C=C(CO)[C@H]1C[C@H](O)[C@@](C)(O)[C@H]1CO,C10H18O4,pos_1_1proton1acetonitrile,202.120509056,ZHKYTTFZXBSTEE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 5385,3439,-1,,,,0.4592942,ISDB,NHZOCAXASXRFNX-JZJYNLBNSA-N,"InChI=1S/C37H64O4/c1-3-4-5-6-7-8-9-10-14-17-20-23-26-33-35(40-33)28-29-36-34(41-36)27-24-21-18-15-12-11-13-16-19-22-25-32-30-31(2)39-37(32)38/h17,20,30-31,33-36H,3-16,18-19,21-29H2,1-2H3/b20-17-",CCCCCCCCCC/C=C\CCC1OC1CCC1OC1CCCCCCCCCCCCC1=CC(C)OC1=O,C37H64O4,,572.480460528,NHZOCAXASXRFNX,Polyketides,Linear polyketides,Acetogenins,Annona reticulata,94924.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona reticulata'],4,0,5.83717679977417 5386,3439,-1,,,,0.4592942,ISDB,NHZOCAXASXRFNX-BPVFOGKOSA-N,"InChI=1S/C37H64O4/c1-3-4-5-6-7-8-9-10-14-17-20-23-26-33-35(40-33)28-29-36-34(41-36)27-24-21-18-15-12-11-13-16-19-22-25-32-30-31(2)39-37(32)38/h17,20,30-31,33-36H,3-16,18-19,21-29H2,1-2H3/b20-17-/t31-,33+,34-,35-,36+/m1/s1",CCCCCCCCCC/C=C\CC[C@@H]1O[C@@H]1CC[C@@H]1O[C@@H]1CCCCCCCCCCCCC1=C[C@@H](C)OC1=O,C37H64O4,,572.480460528,NHZOCAXASXRFNX,Polyketides,Linear polyketides,Acetogenins,Uvaria chamae,340656.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Uvaria'],['Uvaria chamae'],4,0,5.83717679977417 5387,3439,-1,,,,0.4592942,ISDB,NHZOCAXASXRFNX-JZJYNLBNSA-N,"InChI=1S/C37H64O4/c1-3-4-5-6-7-8-9-10-14-17-20-23-26-33-35(40-33)28-29-36-34(41-36)27-24-21-18-15-12-11-13-16-19-22-25-32-30-31(2)39-37(32)38/h17,20,30-31,33-36H,3-16,18-19,21-29H2,1-2H3/b20-17-",CCCCCCCCCC/C=C\CCC1OC1CCC1OC1CCCCCCCCCCCCC1=CC(C)OC1=O,C37H64O4,,572.480460528,NHZOCAXASXRFNX,Polyketides,Linear polyketides,Acetogenins,Ophrypetalum odoratum,181025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Monodoreae'],['Ophrypetalum'],['Ophrypetalum odoratum'],4,0,5.83717679977417 5388,3439,-1,,,,0.4592942,ISDB,NHZOCAXASXRFNX-OCNDSIHXSA-N,"InChI=1S/C37H64O4/c1-3-4-5-6-7-8-9-10-14-17-20-23-26-33-35(40-33)28-29-36-34(41-36)27-24-21-18-15-12-11-13-16-19-22-25-32-30-31(2)39-37(32)38/h17,20,30-31,33-36H,3-16,18-19,21-29H2,1-2H3/b20-17+/t31-,33+,34-,35-,36-/m1/s1",CCCCCCCCCC/C=C/CC[C@@H]1O[C@@H]1CC[C@H]1O[C@@H]1CCCCCCCCCCCCC1=C[C@@H](C)OC1=O,C37H64O4,,572.480460528,NHZOCAXASXRFNX,Polyketides,Linear polyketides,Acetogenins,Annona squamosa,915056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona squamosa'],4,0,5.83717679977417 5389,3437,-1,,,,0.0,MS1_match,PUJPMGBYYYNBII-OGVVJMRYSA-N,"InChI=1S/C24H39NO4/c1-6-25-12-22(2)8-7-18(28-4)24-14-9-13-16(27-3)11-23(29-5,19(14)20(13)26)15(21(24)25)10-17(22)24/h13-21,26H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO4,pos_2_2proton1ammonium,405.2879087279999,PUJPMGBYYYNBII,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,0,6.0 5390,3429,-1,,,,0.21762525,ISDB,DZGWFCGJZKJUFP-UHFFFAOYSA-N,"InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2",NCCc1ccc(O)cc1,C8H11NO,,137.084063972,DZGWFCGJZKJUFP,Alkaloids,Tyrosine alkaloids,Phenylethylamines,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,0,8.870500981807709 5391,3427,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,JFDDBMVESRQDLZ-MEIPJHLESA-N,"InChI=1S/C22H29NO5/c1-8-4-21-7-11-16-20(3)5-10(25)6-22(16)17(21)14(26)12(8)15(28-9(2)24)13(21)18(22)23(11)19(20)27/h10-19,25-27H,1,4-7H2,2-3H3/t10-,11-,12+,13+,14-,15+,16+,17+,18+,19-,20-,21-,22-/m0/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@]6(C)C[C@H](O)C[C@@]57[C@@H]2[C@@H](O)[C@@H]1[C@@H](OC(C)=O)[C@@H]3[C@H]7N4[C@H]6O,C22H29NO5,pos_2MHNH3,387.204573028,JFDDBMVESRQDLZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 5392,3427,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,JFDDBMVESRQDLZ-MEIPJHLESA-N,"InChI=1S/C22H29NO5/c1-8-4-21-7-11-16-20(3)5-10(25)6-22(16)17(21)14(26)12(8)15(28-9(2)24)13(21)18(22)23(11)19(20)27/h10-19,25-27H,1,4-7H2,2-3H3/t10-,11-,12+,13+,14-,15+,16+,17+,18+,19-,20-,21-,22-/m0/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@]6(C)C[C@H](O)C[C@@]57[C@@H]2[C@@H](O)[C@@H]1[C@@H](OC(C)=O)[C@@H]3[C@H]7N4[C@H]6O,C22H29NO5,pos_2MHNH3,387.204573028,JFDDBMVESRQDLZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 5393,3427,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,KLDNQFXMBMDPMZ-UHFFFAOYSA-N,"InChI=1S/C22H29NO5/c1-9-6-20-7-22(27)18-19(3)8-23(22)17-13(20)15(28-10(2)24)12(9)14(26)16(20)21(17,18)5-4-11(19)25/h11-18,25-27H,1,4-8H2,2-3H3",C=C1CC23CC4(O)C5C6(C)CN4C4C2C(OC(C)=O)C1C(O)C3C45CCC6O,C22H29NO5,pos_2MHNH3,387.204573028,KLDNQFXMBMDPMZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium majus,6131723.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium majus'],6,0,6.0 5394,3427,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,XGTNTUKODZZCGL-FARGTZJHSA-N,"InChI=1S/C22H29NO5/c1-9-4-20-7-12-15-19(3)5-11(28-10(2)24)6-21(15)16(20)14(25)13(9)17(26)22(20,27)18(21)23(12)8-19/h11-18,25-27H,1,4-8H2,2-3H3/t11-,12-,13+,14+,15+,16+,17-,18-,19-,20+,21-,22-/m0/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@@]6(C)C[C@H](OC(C)=O)C[C@@]57[C@@H]2[C@H](O)[C@@H]1[C@H](O)[C@]3(O)[C@H]7N4C6,C22H29NO5,pos_2MHNH3,387.2045730279999,XGTNTUKODZZCGL,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum coreanum,377294.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum coreanum'],6,0,6.0 5395,3427,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,FGERYDCMGOEROV-DUSGFXKJSA-N,"InChI=1S/C22H29NO5/c1-9-5-20-7-13-15-19(3)8-14(28-10(2)24)17(25)22(15)16(23(13)18(19)26)12(20)4-11(9)6-21(20,22)27/h11-18,25-27H,1,4-8H2,2-3H3/t11-,12+,13-,14-,15+,16+,17+,18+,19-,20-,21-,22+/m0/s1",C=C1C[C@]23C[C@H]4[C@@H]5[C@]6(C)C[C@H](OC(C)=O)[C@@H](O)[C@]57[C@@H]([C@H]2C[C@H]1C[C@]37O)N4[C@@H]6O,C22H29NO5,pos_2MHNH3,387.204573028,FGERYDCMGOEROV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,0,6.0 5396,3427,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,FGERYDCMGOEROV-DUSGFXKJSA-N,"InChI=1S/C22H29NO5/c1-9-5-20-7-13-15-19(3)8-14(28-10(2)24)17(25)22(15)16(23(13)18(19)26)12(20)4-11(9)6-21(20,22)27/h11-18,25-27H,1,4-8H2,2-3H3/t11-,12+,13-,14-,15+,16+,17+,18+,19-,20-,21-,22+/m0/s1",C=C1C[C@]23C[C@H]4[C@@H]5[C@]6(C)C[C@H](OC(C)=O)[C@@H](O)[C@]57[C@@H]([C@H]2C[C@H]1C[C@]37O)N4[C@@H]6O,C22H29NO5,pos_2MHNH3,387.204573028,FGERYDCMGOEROV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 5397,3426,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.35320532,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Corbicula sandai,920655.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Venerida'],['Cyrenidae'],['Unknown'],['Corbicula'],['Corbicula sandai'],1,3,3.9128212928771973 5398,3426,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.35320532,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Crassostrea gigas,987409.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Ostreida'],['Ostreidae'],['Unknown'],['Magallana'],['Magallana gigas'],1,3,3.9128212928771973 5399,3426,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.35320532,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Magallana gigas,987409.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Ostreida'],['Ostreidae'],['Unknown'],['Magallana'],['Magallana gigas'],1,3,3.9128212928771973 5400,3426,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.35320532,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Corbicula japonica,920654.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Venerida'],['Cyrenidae'],['Unknown'],['Corbicula'],['Corbicula japonica'],1,3,3.9128212928771973 5401,3422,-1,,,,0.35838637,ISDB,QFANMAOKAWEBQA-UHFFFAOYSA-N,"InChI=1S/C20H32O2/c1-13(2)10-19(21)22-12-14(3)11-17-8-6-15(4)18-9-7-16(5)20(17)18/h11,13,15,17-18H,6-10,12H2,1-5H3",CC(=CC1CCC(C)C2CCC(C)=C12)COC(=O)CC(C)C,C20H32O2,,304.240230264,QFANMAOKAWEBQA,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,7.433545470237732 5402,3421,592,Fatty acids,Fatty acyls,Fatty ethers,0.5388961,ISDB,ZHADMZSKNJUERU-BWLZIVRNSA-N,"InChI=1S/C19H30O3/c1-3-4-5-6-8-11-14-17-22-18-15-12-9-7-10-13-16-19(20)21-2/h4-5,8,11,14-15,17-18H,3,6-7,9-10,12-13,16H2,1-2H3/b5-4-,11-8-,17-14+,18-15+",CC/C=C\C/C=C\C=C\O/C=C/CCCCCCC(=O)OC,C19H30O3,,306.21949482,ZHADMZSKNJUERU,Fatty acids,Fatty acyls,Fatty ethers,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,7.655584335327148 5403,3419,800,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,0.6526342,ISDB,QSWUCBJNTODEKO-UHFFFAOYSA-N,"InChI=1S/C21H22O11/c22-7-14-16(27)17(28)18(29)21(31-14)32-20-15(26)10-3-2-9(23)6-13(10)30-19(20)8-1-4-11(24)12(25)5-8/h1-6,14,16-25,27-29H,7H2",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1OC1OC(CO)C(O)C(O)C1O,C21H22O11,,450.116211524,QSWUCBJNTODEKO,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Baptisia lecontei,3928764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Baptisia'],['Baptisia lecontei'],4,3,8.110536813735962 5404,3416,114,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,DBANWUMRYUJBKJ-SRUNSHPASA-N,"InChI=1S/C36H58O7/c1-20-26(37)27(38)28(39)29(42-20)43-25-12-13-33(6)23(32(25,4)5)11-14-35(8)24(33)10-9-21-22-19-31(2,3)15-17-36(22,30(40)41)18-16-34(21,35)7/h9,20,22-29,37-39H,10-19H2,1-8H3,(H,40,41)/t20-,22-,23-,24+,25-,26-,27+,28+,29-,33-,34+,35+,36-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O)[C@H](O)[C@H]1O,C36H58O7,pos_1_1sodium1acetonitrile,602.418254196,DBANWUMRYUJBKJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone narcissiflora,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,3,8.5 5405,3416,114,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,DBANWUMRYUJBKJ-SRUNSHPASA-N,"InChI=1S/C36H58O7/c1-20-26(37)27(38)28(39)29(42-20)43-25-12-13-33(6)23(32(25,4)5)11-14-35(8)24(33)10-9-21-22-19-31(2,3)15-17-36(22,30(40)41)18-16-34(21,35)7/h9,20,22-29,37-39H,10-19H2,1-8H3,(H,40,41)/t20-,22-,23-,24+,25-,26-,27+,28+,29-,33-,34+,35+,36-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O)[C@H](O)[C@H]1O,C36H58O7,pos_1_1sodium1acetonitrile,602.418254196,DBANWUMRYUJBKJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone multifida,896056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone multifida'],7,3,8.5 5406,3416,114,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,DBANWUMRYUJBKJ-SRUNSHPASA-N,"InChI=1S/C36H58O7/c1-20-26(37)27(38)28(39)29(42-20)43-25-12-13-33(6)23(32(25,4)5)11-14-35(8)24(33)10-9-21-22-19-31(2,3)15-17-36(22,30(40)41)18-16-34(21,35)7/h9,20,22-29,37-39H,10-19H2,1-8H3,(H,40,41)/t20-,22-,23-,24+,25-,26-,27+,28+,29-,33-,34+,35+,36-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O)[C@H](O)[C@H]1O,C36H58O7,pos_1_1sodium1acetonitrile,602.418254196,DBANWUMRYUJBKJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum narcissiflorum,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,3,8.5 5407,3415,-1,,,,0.34507185,ISDB,QWUZNYCFLGLOKN-UHFFFAOYSA-N,"InChI=1S/C29H58O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-28(30)26-24-27-29(31)32/h28,30H,2-27H2,1H3,(H,31,32)",CCCCCCCCCCCCCCCCCCCCCCCCC(O)CCCC(=O)O,C29H58O3,,454.438595716,QWUZNYCFLGLOKN,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Cerinthe minor,98424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Boraginaceae'],['Lithospermeae'],['Cerinthe'],['Cerinthe minor'],4,0,5.380287408828735 5408,3414,758,Carbohydrates,Saccharides,Humulane sesquiterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,2,8.0 5409,3414,758,Carbohydrates,Saccharides,Humulane sesquiterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Euonymus europaeus,806632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus europaeus'],7,2,8.0 5410,3412,1405,Terpenoids,Diterpenoids,Labdane diterpenoids,0.33302855,ISDB,MUMIKPZQGINHTM-GRUHYRDCSA-N,"InChI=1S/C25H40O5/c1-6-17(2)23(29)30-22-11-13-24(4)20(9-8-19(15-27)12-14-26)18(3)7-10-21(24)25(22,5)16-28/h6,12,20-22,26-28H,3,7-11,13-16H2,1-2,4-5H3/b17-6-,19-12-/t20-,21+,22-,24+,25-/m1/s1",C=C1CC[C@H]2[C@@](C)(CC[C@@H](OC(=O)/C(C)=C\C)[C@]2(C)CO)[C@@H]1CC/C(=C/CO)CO,C25H40O5,,420.28757438,MUMIKPZQGINHTM,Terpenoids,Diterpenoids,Labdane diterpenoids,Brickellia lemmonii,3899947.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Brickellia'],['Brickellia lemmonii'],4,3,6.832114219665527 5411,3411,-1,,,,0.40773675,ISDB,AGHYYIRUYLLBAR-DOTOQJQBSA-N,"InChI=1S/C19H32O4/c1-15(20)9-7-5-3-2-4-6-8-10-17(21)11-16-12-18(22)14-19(23)13-16/h12-15,17,20-23H,2-11H2,1H3/t15-,17+/m0/s1",C[C@H](O)CCCCCCCCC[C@@H](O)Cc1cc(O)cc(O)c1,C19H32O4,,324.230059504,AGHYYIRUYLLBAR,Polyketides,,,Ononis pubescens,323322.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis pubescens'],4,0,5.63094699382782 5412,3410,1305,Alkaloids,Pseudoalkaloids,Phenylalanine-derived alkaloids,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_2_2proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],8,1,8.5 5413,3410,1305,Alkaloids,Pseudoalkaloids,Phenylalanine-derived alkaloids,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_2_2proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,1,8.5 5414,3410,1305,Alkaloids,Pseudoalkaloids,Phenylalanine-derived alkaloids,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_2_2proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,1,8.5 5415,3409,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GGMCFLXPZMBJMV-NPVWYNPDSA-N,"InChI=1S/C24H26O13/c1-32-11-5-4-9(6-10(11)26)21-23(34-3)18(29)15-12(35-21)7-13(22(33-2)17(15)28)36-24-20(31)19(30)16(27)14(8-25)37-24/h4-7,14,16,19-20,24-28,30-31H,8H2,1-3H3/t14-,16-,19+,20-,24-/m1/s1",COc1ccc(-c2oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c(O)c3c(=O)c2OC)cc1O,C24H26O13,pos_1_1proton1ammonium,522.1373408919998,GGMCFLXPZMBJMV,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus laetus,714302.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus laetus'],6,1,6.5 5416,3409,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NYTZRFVFIRTFIX-NPVWYNPDSA-N,"InChI=1S/C24H26O13/c1-32-11-6-9(4-5-10(11)26)21-23(34-3)18(29)15-12(35-21)7-13(22(33-2)17(15)28)36-24-20(31)19(30)16(27)14(8-25)37-24/h4-7,14,16,19-20,24-28,30-31H,8H2,1-3H3/t14-,16-,19+,20-,24-/m1/s1",COc1cc(-c2oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c(O)c3c(=O)c2OC)ccc1O,C24H26O13,pos_1_1proton1ammonium,522.137340892,NYTZRFVFIRTFIX,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus laetus,714302.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus laetus'],6,1,6.5 5417,3409,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WFTGLRVDKFXNSB-HPCJZBTHSA-N,"InChI=1S/C24H26O13/c1-32-12-6-9(4-5-10(12)26)20-23(34-3)17(29)15-13(35-20)7-11(27)21(33-2)22(15)37-24-19(31)18(30)16(28)14(8-25)36-24/h4-7,14,16,18-19,24-28,30-31H,8H2,1-3H3/t14-,16-,18+,19-,24+/m1/s1",COc1cc(-c2oc3cc(O)c(OC)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3c(=O)c2OC)ccc1O,C24H26O13,pos_1_1proton1ammonium,522.1373408919998,WFTGLRVDKFXNSB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus laetus,714302.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus laetus'],6,1,6.5 5418,3409,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WFTGLRVDKFXNSB-HPCJZBTHSA-N,"InChI=1S/C24H26O13/c1-32-12-6-9(4-5-10(12)26)20-23(34-3)17(29)15-13(35-20)7-11(27)21(33-2)22(15)37-24-19(31)18(30)16(28)14(8-25)36-24/h4-7,14,16,18-19,24-28,30-31H,8H2,1-3H3/t14-,16-,18+,19-,24+/m1/s1",COc1cc(-c2oc3cc(O)c(OC)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3c(=O)c2OC)ccc1O,C24H26O13,pos_1_1proton1ammonium,522.1373408919998,WFTGLRVDKFXNSB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus laetus,714302.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus laetus'],6,1,6.5 5419,3405,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.8003175,ISDB,ZCCLDKGWJIREQF-PDBXOOCHSA-N,"InChI=1S/C21H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h3-4,6-7,9-10,20,22-23H,2,5,8,11-19H2,1H3/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO,C21H36O4,,352.261359632,ZCCLDKGWJIREQF,Fatty acids,Glycerolipids,Monoacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,3,8.70127010345459 5420,3402,-1,,,,0.2732222,ISDB,,,,,,,IEUNGVZFLKERGL,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0928888320922852 5421,3401,-1,,,,0.24435204,ISDB,,,,,,,NVQPWUVLWFUODC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9774081707000732 5422,3400,66,Shikimates and Phenylpropanoids,Chromanes,Chromones,0.0,MS1_match,VOGRFGIBINTSKJ-UHFFFAOYSA-N,"InChI=1S/C25H32O7/c1-15(2)9-24(28)31-14-19-18(10-16-5-7-20(26)22(11-16)29-3)13-32-25(19)17-6-8-21(27)23(12-17)30-4/h5-8,11-12,15,18-19,25-27H,9-10,13-14H2,1-4H3",COc1cc(CC2COC(c3ccc(O)c(OC)c3)C2COC(=O)CC(C)C)ccc1O,C25H32O7,pos_1_1proton1methanol,444.214803364,VOGRFGIBINTSKJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,1,6.5 5423,3400,66,Shikimates and Phenylpropanoids,Chromanes,Chromones,0.0,MS1_match,VOGRFGIBINTSKJ-UHFFFAOYSA-N,"InChI=1S/C25H32O7/c1-15(2)9-24(28)31-14-19-18(10-16-5-7-20(26)22(11-16)29-3)13-32-25(19)17-6-8-21(27)23(12-17)30-4/h5-8,11-12,15,18-19,25-27H,9-10,13-14H2,1-4H3",COc1cc(CC2COC(c3ccc(O)c(OC)c3)C2COC(=O)CC(C)C)ccc1O,C25H32O7,pos_1_1proton1methanol,444.214803364,VOGRFGIBINTSKJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,1,6.5 5424,3399,311,Terpenoids,Sesquiterpenoids,Noreremophilane sesquiterpenoids,0.22839613,ISDB,UGDVDUDNGSZKIS-HRVVTOCWSA-N,"InChI=1S/C29H38O3/c1-16-9-7-11-21-13-25-27(18(3)26(16)21)19(4)28(32-25)31-24-14-22-12-8-10-17(2)29(22,6)15-23(24)20(5)30/h13,16-17,22H,7-12,14-15H2,1-6H3/t16-,17-,22+,29+/m0/s1",CC(=O)C1=C(Oc2oc3cc4c(c(C)c3c2C)[C@@H](C)CCC4)C[C@H]2CCC[C@H](C)[C@@]2(C)C1,C29H38O3,,434.282095076,UGDVDUDNGSZKIS,Terpenoids,Sesquiterpenoids,Noreremophilane sesquiterpenoids,Ligularia muliensis,7051955.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia muliensis'],4,3,6.413584530353546 5425,3395,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1potassium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 5426,3392,-1,,,,0.40577567,ISDB,ZRLAOEYZSKXGSL-RZRNQMRLSA-N,"InChI=1S/C43H70O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,22,36-37,40-44,47-49H,3-4,9-10,15-16,20-21,23-35H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,18-17-,22-19-/t36-,37-,40+,41+,42-,43-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCC/C=C\C/C=C\C/C=C\CC,C43H70O10,,746.49689844,ZRLAOEYZSKXGSL,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,5.62310266494751 5427,3391,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.0,MS1_match,YWNUNVSMOKMJMG-LJAQVGFWSA-N,"InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3/t29-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3cc(OC)c(cc31)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3,C38H40N2O7,pos_1_1proton2acetonitrile,636.28355162,YWNUNVSMOKMJMG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,3,7.5 5428,3391,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.0,MS1_match,YWNUNVSMOKMJMG-UHFFFAOYSA-N,"InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3",COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3cc(OC)c(cc31)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C38H40N2O7,pos_1_1proton2acetonitrile,636.28355162,YWNUNVSMOKMJMG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,3,7.5 5429,3391,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.0,MS1_match,YWNUNVSMOKMJMG-UHFFFAOYSA-N,"InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3",COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3cc(OC)c(cc31)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C38H40N2O7,pos_1_1proton2acetonitrile,636.28355162,YWNUNVSMOKMJMG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lucidum,977702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lucidum'],6,3,7.5 5430,3391,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.0,MS1_match,YWNUNVSMOKMJMG-UHFFFAOYSA-N,"InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3",COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3cc(OC)c(cc31)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C38H40N2O7,pos_1_1proton2acetonitrile,636.28355162,YWNUNVSMOKMJMG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum rugosum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,3,7.5 5431,3391,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.0,MS1_match,YWNUNVSMOKMJMG-UHFFFAOYSA-N,"InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3",COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3cc(OC)c(cc31)Oc1c(OC)c(OC)c(OC)c3c1C(C2)N(C)CC3,C38H40N2O7,pos_1_1proton2acetonitrile,636.28355162,YWNUNVSMOKMJMG,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum foliolosum,124406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foliolosum'],6,3,7.5 5432,3391,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.0,MS1_match,MWGNKNYAZMCDHD-VMPREFPWSA-N,"InChI=1S/C38H40N2O7/c1-39-12-10-22-16-30(42-2)33-19-27(22)28(39)14-21-6-8-25(9-7-21)46-32-17-23-15-29-34-26(11-13-40(29)20-24(23)18-31(32)43-3)35(41)37(44-4)38(45-5)36(34)47-33/h6-9,16-19,28-29,41H,10-15,20H2,1-5H3/t28-,29-/m0/s1",COc1cc2c3cc1Oc1ccc(cc1)C[C@H]1c4cc(c(OC)cc4CCN1C)Oc1c(OC)c(OC)c(O)c4c1[C@H](C3)N(CC4)C2,C38H40N2O7,pos_1_1proton2acetonitrile,636.28355162,MWGNKNYAZMCDHD,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum longistylum,6133329.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum longistylum'],6,3,7.5 5433,3390,697,Polyketides,Aromatic polyketides,Catechols with side chains,0.45095193,ISDB,BENPXLIQKFYNHW-UHFFFAOYSA-N,"InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)20-24-21-26(29)23-27(30)22-24/h21-23,29-30H,2-20H2,1H3",CCCCCCCCCCCCCCCCCCCC(=O)Cc1cc(O)cc(O)c1,C27H46O3,,418.344695332,BENPXLIQKFYNHW,Polyketides,Aromatic polyketides,Catechols with side chains,Triticum aestivum,31926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Triticum'],['Triticum aestivum'],4,3,7.303807735443115 5434,3390,697,Polyketides,Aromatic polyketides,Catechols with side chains,0.45095193,ISDB,BENPXLIQKFYNHW-UHFFFAOYSA-N,"InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)20-24-21-26(29)23-27(30)22-24/h21-23,29-30H,2-20H2,1H3",CCCCCCCCCCCCCCCCCCCC(=O)Cc1cc(O)cc(O)c1,C27H46O3,,418.344695332,BENPXLIQKFYNHW,Polyketides,Aromatic polyketides,Catechols with side chains,Secale cereale,553015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Secale'],['Secale cereale'],4,3,7.303807735443115 5435,3382,816,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_2MH,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 5436,3382,816,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_2MH,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 5437,3381,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.4570604,ISDB,,,,,,,ZUYBPGVWQFOYNA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.8282415866851807 5438,3380,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.22307478,ISDB,,,,,,,BJNGJUDLULXJAZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8922991156578064 5439,3378,-1,,,,0.23041746,ISDB,RVUOLUXECYIMSX-ZCYQVOJMSA-N,"InChI=1S/C29H50O6/c1-4-5-6-8-11-15-23(2)16-12-9-7-10-13-18-25(30)22-28(32)35-19-14-17-24-20-26(31)29(33)27(21-24)34-3/h20-21,23,25,30-31,33H,4-19,22H2,1-3H3/t23-,25-/m0/s1",CCCCCCC[C@H](C)CCCCCCC[C@H](O)CC(=O)OCCCc1cc(O)c(O)c(OC)c1,C29H50O6,,494.36073932,RVUOLUXECYIMSX,,,,Lasiolaena morii,5920860.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Lasiolaena'],['Lasiolaena morii'],4,0,4.921669840812683 5440,3375,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CXBGOBGJHGGWIE-ACSXSLCXSA-N,"InChI=1S/C25H32N2O6/c1-6-23-10-7-12-27-13-11-24(19(23)27)17-9-8-16(31-4)14-18(17)26(3)20(24)25(30,22(29)32-5)21(23)33-15(2)28/h7-10,14,19-21,30H,6,11-13H2,1-5H3/t19-,20+,21+,23+,24+,25-/m0/s1",CC[C@]12C=CCN3CC[C@@]4(c5ccc(OC)cc5N(C)[C@H]4[C@@](O)(C(=O)OC)[C@@H]1OC(C)=O)[C@@H]32,C25H32N2O6,pos_1_1proton1acetonitrile,456.226036744,CXBGOBGJHGGWIE,Alkaloids,Tryptophan alkaloids,Aspidosperma type,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 5441,3368,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.21719141,ISDB,DEUAMKIXCAXPMV-UHFFFAOYSA-N,"InChI=1S/C24H38N2O4/c1-6-23(4)11-9-17-16(15-23)7-8-18-22(2,3)19(10-12-24(17,18)5)30-21(29)26-20(28)25-13-14-27/h6,9,16,18-19,27H,1,7-8,10-15H2,2-5H3,(H2,25,26,28,29)",C=CC1(C)CC=C2C(CCC3C2(C)CCC(OC(=O)NC(=O)NCCO)C3(C)C)C1,C24H38N2O4,,418.283157696,DEUAMKIXCAXPMV,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Streptomyces albidoflavus,772836.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Streptomyces albidoflavus'],0,1,1.368765652179718 5442,3368,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.21719141,ISDB,DEUAMKIXCAXPMV-LQBJFXQCSA-N,"InChI=1S/C24H38N2O4/c1-6-23(4)11-9-17-16(15-23)7-8-18-22(2,3)19(10-12-24(17,18)5)30-21(29)26-20(28)25-13-14-27/h6,9,16,18-19,27H,1,7-8,10-15H2,2-5H3,(H2,25,26,28,29)/t16-,18+,19+,23-,24-/m0/s1",C=C[C@@]1(C)CC=C2[C@@H](CC[C@@H]3C(C)(C)[C@H](OC(=O)NC(=O)NCCO)CC[C@@]23C)C1,C24H38N2O4,,418.283157696,DEUAMKIXCAXPMV,Terpenoids,Diterpenoids,Pimarane and Isopimarane diterpenoids,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,1,1.368765652179718 5443,3364,612,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.20274743,ISDB,ZVTVWDXRNMHGNY-JOGTXEPTSA-N,"InChI=1S/C42H70O12/c1-20(2)11-10-12-21(3)23-13-16-41(8)29(23)24(44)17-27-40(7)15-14-28(45)39(5,6)36(40)25(18-42(27,41)9)52-38-35(33(49)31(47)26(19-43)53-38)54-37-34(50)32(48)30(46)22(4)51-37/h11,22-38,43-50H,3,10,12-19H2,1-2,4-9H3/t22-,23+,24+,25-,26+,27+,28-,29-,30-,31+,32+,33-,34+,35+,36-,37-,38+,40+,41+,42+/m0/s1",C=C(CCC=C(C)C)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)C[C@]12C,C42H70O12,,766.48672768,ZVTVWDXRNMHGNY,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,2,5.810989737510681 5444,3363,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.33018956,ISDB,IVXAFGQCCBSPRS-VOXVIXIFSA-N,"InChI=1S/C31H47NO10/c1-16(12-13-21-19(4)23(34)27(38-7)29(32-21)39-8)10-9-11-17(2)14-18(3)28(31(6)20(5)42-31)41-30-26(37)25(36)24(35)22(15-33)40-30/h9,11-12,14,18,20,22,24-26,28,30,33,35-37H,10,13,15H2,1-8H3,(H,32,34)/b11-9+,16-12+,17-14+/t18-,20-,22-,24-,25+,26-,28-,30+,31+/m1/s1",COc1nc(C/C=C(\C)C/C=C/C(C)=C/[C@@H](C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@]2(C)O[C@@H]2C)c(C)c(O)c1OC,C31H47NO10,,593.3199967039999,IVXAFGQCCBSPRS,Polyketides,,,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,0,1.3207582235336304 5445,3360,449,Shikimates and Phenylpropanoids,Cyclic polyketides,Cinnamic acids and derivatives,0.47566578,ISDB,PFHBQBOWTMLEJD-MRVPVSSYSA-N,"InChI=1S/C11H16O2/c1-4-8(3)10-7-6-9(5-2)11(12)13-10/h6-8H,4-5H2,1-3H3/t8-/m1/s1",CCc1ccc([C@H](C)CC)oc1=O,C11H16O2,,180.115029752,PFHBQBOWTMLEJD,Polyketides,Cyclic polyketides,2-pyrone derivatives,Nocardiopsis,176964.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptosporangiales'],['Nocardiopsaceae'],['Unknown'],['Nocardiopsis'],['Unknown'],0,2,2.9026631116867065 5446,3357,-1,,,,0.59658116,ISDB,PMKICGRXBBLLPW-FYPAKXHLSA-N,"InChI=1S/C18H26O3/c1-4-5-6-7-8-9-10-11-12-13-14-16-17(20-3)15(2)21-18(16)19/h1,14,17H,2,5-13H2,3H3/b16-14+/t17-/m1/s1",C#CCCCCCCCCC/C=C1/C(=O)OC(=C)[C@H]1OC,C18H26O3,,290.188194692,PMKICGRXBBLLPW,Polyketides,,,Lindera glauca,157205.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Lindera'],['Lindera glauca'],4,0,6.386324644088745 5447,3356,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.4384912,ISDB,TZAXQHDIMDQXRD-YJQAKTFBSA-N,"InChI=1S/C19H22O5/c1-4-9-18-10-5-6-16(21)19(18,22)24-17(12(18)2)13-7-8-14(20)15(11-13)23-3/h4-8,11-12,17,20,22H,1,9-10H2,2-3H3/t12-,17+,18-,19-/m1/s1",C=CC[C@]12CC=CC(=O)[C@@]1(O)O[C@H](c1ccc(O)c(OC)c1)[C@H]2C,C19H22O5,,330.146723804,TZAXQHDIMDQXRD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Aniba ferrea,6025335.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Aniba'],['Aniba ferrea'],4,3,7.253964781761169 5448,3349,21,Terpenoids,Steroids,Ergostane steroids,0.26490924,ISDB,FIPQOHZMDJGHRY-UFRBZJLLSA-N,"InChI=1S/C28H36O6/c1-15-18-8-10-27(34-28(15)22(31)16(2)23(3,4)33-28)21-14-20(30)19-13-17(29)7-9-24(19,5)26(21,32)12-11-25(18,27)6/h11-16,18,22,31-32H,7-10H2,1-6H3/t15-,16-,18+,22+,24-,25+,26+,27-,28-/m0/s1",C[C@H]1[C@@H](O)[C@@]2(OC1(C)C)O[C@]13CC[C@H]([C@@H]2C)[C@@]1(C)C=C[C@@]1(O)C3=CC(=O)C2=CC(=O)CC[C@@]21C,C28H36O6,,468.251188872,FIPQOHZMDJGHRY,Terpenoids,Steroids,Ergostane steroids,Agaricus blazei,831704.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Agaricales'],['Agaricaceae'],['Unknown'],['Agaricus'],['Agaricus blazei'],1,3,3.559636950492859 5449,3348,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,AXCXHFKZHDEKTP-UHFFFAOYSA-N,"InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3",COc1ccc(C=CC=O)cc1,C10H10O2,pos_2MH,162.06807956,AXCXHFKZHDEKTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,3,7.5 5450,3346,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 5451,3346,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 5452,3346,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 5453,3346,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 5454,3345,-1,,,,0.0,MS1_match,NUHSROFQTUXZQQ-UHFFFAOYSA-N,"InChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h1,3-4H2,2H3,(H,9,10)(H2,6,7,8)",C=C(C)CCOP(=O)(O)OP(=O)(O)O,C5H12O7P2,pos_1_1proton2acetonitrile,246.005825984,NUHSROFQTUXZQQ,,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5455,3345,-1,,,,0.0,MS1_match,CBIDRCWHNCKSTO-UHFFFAOYSA-N,"InChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h3H,4H2,1-2H3,(H,9,10)(H2,6,7,8)",CC(C)=CCOP(=O)(O)OP(=O)(O)O,C5H12O7P2,pos_1_1proton2acetonitrile,246.005825984,CBIDRCWHNCKSTO,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5456,3340,-1,,,,0.7362921,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,0,6.945168495178223 5457,3339,536,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.381776,ISDB,DDMIPYQLIZVPJH-CCPSRCKYSA-N,"InChI=1S/C19H28O8/c1-10-4-5-19(27-10)11(6-12(21)7-18(19,2)3)9-25-17-16(24)15(23)14(22)13(8-20)26-17/h4-6,10,13-17,20,22-24H,7-9H2,1-3H3/t10-,13-,14-,15+,16-,17-,19-/m1/s1",C[C@@H]1C=C[C@@]2(O1)C(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=CC(=O)CC2(C)C,C19H28O8,,384.178417856,DDMIPYQLIZVPJH,Terpenoids,,,Excoecaria cochinchinensis,1011992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Hippomaneae'],['Excoecaria'],['Excoecaria cochinchinensis'],4,1,6.027104020118713 5458,3337,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5714827,ISDB,IVGYNKMUKVTWBT-ZNABNZNXSA-N,"InChI=1S/C30H48/c1-20(2)21-11-13-28(6)22(21)12-14-30(8)25(28)10-9-23-24-19-26(3,4)15-16-27(24,5)17-18-29(23,30)7/h9,12,20-21,24-25H,10-11,13-19H2,1-8H3/t21-,24+,25-,27-,28+,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@]2(C)C1=CC[C@]1(C)[C@@H]2CC=C2[C@@H]3CC(C)(C)CC[C@]3(C)CC[C@]21C,C30H48,,408.375601536,IVGYNKMUKVTWBT,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Viburnum opulus,117453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum opulus'],5,2,8.285930871963501 5459,3336,-1,,,,0.41542822,ISDB,PCARJFWVFUEFLY-XMMPIXPASA-N,"InChI=1S/C24H27NO2/c1-15(2)8-7-12-24(4)13-11-18-21-19(14-16(3)23(18)27-24)17-9-6-10-20(26-5)22(17)25-21/h6,8-11,13-14,25H,7,12H2,1-5H3/t24-/m1/s1",COc1cccc2c1[nH]c1c3c(c(C)cc12)O[C@](C)(CCC=C(C)C)C=C3,C24H27NO2,,361.204179104,PCARJFWVFUEFLY,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Murraya euchrestifolia,5233070.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya euchrestifolia'],4,0,5.661712884902954 5460,3336,-1,,,,0.41542822,ISDB,PCARJFWVFUEFLY-UHFFFAOYSA-N,"InChI=1S/C24H27NO2/c1-15(2)8-7-12-24(4)13-11-18-21-19(14-16(3)23(18)27-24)17-9-6-10-20(26-5)22(17)25-21/h6,8-11,13-14,25H,7,12H2,1-5H3",COc1cccc2c1[nH]c1c3c(c(C)cc12)OC(C)(CCC=C(C)C)C=C3,C24H27NO2,,361.2041791040001,PCARJFWVFUEFLY,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Murraya koenigii,321836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Bergera'],['Bergera koenigii'],4,0,5.661712884902954 5461,3334,-1,,,,0.23545724,ISDB,CJUHYIMRYOMZHW-PZKIOYHUSA-N,"InChI=1S/C19H36O8/c1-10(22)4-5-13-11(8-20)6-12(7-19(13,2)3)26-18-17(25)16(24)15(23)14(9-21)27-18/h10-18,20-25H,4-9H2,1-3H3/t10-,11+,12-,13+,14+,15+,16-,17+,18+/m0/s1",C[C@H](O)CC[C@@H]1[C@@H](CO)C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C19H36O8,,392.241018112,CJUHYIMRYOMZHW,Terpenoids,Apocarotenoids,Megastigmanes,Melia azedarach,916052.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Melia'],['Melia azedarach'],4,0,4.941828966140747 5462,3331,-1,,,,0.5256623,ISDB,IVZWRQBQDVHDNG-KUIXFMFUSA-N,"InChI=1S/C20H34/c1-14-12-20-11-8-16-18(2,3)9-5-10-19(16,4)17(20)7-6-15(14)13-20/h14-17H,5-13H2,1-4H3/t14-,15+,16+,17-,19+,20+/m0/s1",C[C@H]1C[C@@]23CC[C@@H]4C(C)(C)CCC[C@@]4(C)[C@@H]2CC[C@@H]1C3,C20H34,,274.266051088,IVZWRQBQDVHDNG,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Aristolochia triangularis,603714.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia triangularis'],4,0,6.102649211883545 5463,3330,1649,Fatty acids,Glycerophospholipids,Glycerophosphoserines,0.3168925,ISDB,BWQAJZLCZFRDSD-FQGNUJBYSA-N,"InChI=1S/C40H76NO10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h14,16,36-37H,3-13,15,17-35,41H2,1-2H3,(H,44,45)(H,46,47)/b16-14-/t36-,37+/m1/s1",CCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O,C40H76NO10P,,761.520684262,BWQAJZLCZFRDSD,Fatty acids,Glycerophospholipids,Glycerophosphoserines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,3.7675700187683105 5464,3330,1649,Fatty acids,Glycerophospholipids,Glycerophosphoserines,0.3168925,ISDB,BWQAJZLCZFRDSD-FQGNUJBYSA-N,"InChI=1S/C40H76NO10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h14,16,36-37H,3-13,15,17-35,41H2,1-2H3,(H,44,45)(H,46,47)/b16-14-/t36-,37+/m1/s1",CCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O,C40H76NO10P,,761.520684262,BWQAJZLCZFRDSD,Fatty acids,Glycerophospholipids,Glycerophosphoserines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,3.7675700187683105 5465,3327,-1,,,,0.22749303,ISDB,XRIDGQVLGQMCMX-OLEFQQMKSA-N,"InChI=1S/C15H16O7/c1-20-12-6-9(2-4-10(12)16)3-5-14(18)21-8-13-11(17)7-15(19)22-13/h2-6,11,13,16-17H,7-8H2,1H3/b5-3+/t11-,13+/m0/s1",COc1cc(/C=C/C(=O)OC[C@H]2OC(=O)C[C@@H]2O)ccc1O,C15H16O7,,308.089602852,XRIDGQVLGQMCMX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],4,0,4.909972131252289 5466,3323,-1,,,,0.0,MS1_match,KISTVNFIXBOXIR-UHFFFAOYSA-N,"InChI=1S/C53H88O21/c1-23(19-67-46-41(64)38(61)36(59)30(72-46)21-69-45-40(63)34(57)28(56)20-68-45)8-9-27(55)24(2)26-12-14-51(7)32-11-10-31-49(4,5)33(13-15-52(31)22-53(32,52)17-16-50(26,51)6)73-47-43(66)39(62)44(25(3)70-47)74-48-42(65)37(60)35(58)29(18-54)71-48/h8,24-48,54-66H,9-22H2,1-7H3",CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(C)C(OC5OC(C)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC45CC35CCC12C)COC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O,C53H88O21,pos_3_1proton2sodium,1060.581809836,KISTVNFIXBOXIR,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum fortunei,5728049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fortunei'],6,0,6.0 5467,3322,-1,,,,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_2MHNH3,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5468,3322,-1,,,,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_2MHNH3,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5469,3321,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.45608252,ISDB,HQQUWEPSOVTLND-OTEXYFMMSA-N,"InChI=1S/C27H36O4/c1-20(11-7-8-12-21(2)14-10-16-28)13-9-15-22(3)24(30)19-27-25(4,5)17-23(29)18-26(27,6)31-27/h7-16,23,29H,17-19H2,1-6H3/b8-7+,13-9+,14-10+,20-11+,21-12+,22-15+/t23-,26-,27-/m0/s1",CC(/C=C/C=O)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)C[C@@]12O[C@@]1(C)C[C@@H](O)CC2(C)C,C27H36O4,,424.261359632,HQQUWEPSOVTLND,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Phaeodactylum tricornutum,529438.0,['Eukaryota'],['Unknown'],['Bacillariophyta'],['Bacillariophyceae'],['Unknown'],['Unknown'],['Unknown'],['Phaeodactylum'],['Phaeodactylum tricornutum'],0,1,2.3243300914764404 5470,3320,693,Terpenoids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,SNJXXMIUXNTITL-JLISYNOWSA-N,"InChI=1S/C23H33NO5/c1-11(25)29-14-8-21-13-7-15-20(2)5-4-17(26)23(15,18(13)24(3)9-20)16(21)6-12(14)22(10-28-22)19(21)27/h12-19,26-27H,4-10H2,1-3H3/t12-,13+,14+,15-,16-,17+,18-,19+,20-,21-,22-,23+/m1/s1",CC(=O)O[C@H]1C[C@]23[C@H](O)[C@@]4(CO4)[C@@H]1C[C@H]2[C@]12[C@@H]4C[C@H]3[C@H]1N(C)C[C@@]4(C)CC[C@@H]2O,C23H33NO5,pos_2MHCH3CN,403.235873156,SNJXXMIUXNTITL,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum delphiniifolium,506023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum delphiniifolium'],6,3,7.5 5471,3320,693,Terpenoids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XSDJVVZNKHIOBC-PRVJHFKZSA-N,"InChI=1S/C24H33NO5/c1-11(2)18(27)30-17-12(3)23(28)8-13-15-21-7-5-6-20(4)10-25(15)24(29,19(20)21)9-22(13,17)14(21)16(23)26/h11,13-17,19,26,28-29H,3,5-10H2,1-2,4H3/t13-,14+,15-,16-,17+,19-,20+,21+,22-,23+,24-/m1/s1",C=C1[C@H](OC(=O)C(C)C)[C@@]23C[C@@]4(O)[C@@H]5[C@@]6(C)CCC[C@@]57[C@@H]2[C@@H](O)[C@]1(O)C[C@@H]3[C@H]7N4C6,C24H33NO5,pos_2MHNH3,415.235873156,XSDJVVZNKHIOBC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,3,7.5 5472,3320,693,Terpenoids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,XSDJVVZNKHIOBC-PRVJHFKZSA-N,"InChI=1S/C24H33NO5/c1-11(2)18(27)30-17-12(3)23(28)8-13-15-21-7-5-6-20(4)10-25(15)24(29,19(20)21)9-22(13,17)14(21)16(23)26/h11,13-17,19,26,28-29H,3,5-10H2,1-2,4H3/t13-,14+,15-,16-,17+,19-,20+,21+,22-,23+,24-/m1/s1",C=C1[C@H](OC(=O)C(C)C)[C@@]23C[C@@]4(O)[C@@H]5[C@@]6(C)CCC[C@@]57[C@@H]2[C@@H](O)[C@]1(O)C[C@@H]3[C@H]7N4C6,C24H33NO5,pos_2MHNH3,415.235873156,XSDJVVZNKHIOBC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium halteratum,209854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium halteratum'],6,3,7.5 5473,3320,693,Terpenoids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,BKHLAQWOXOLRLR-NBNRPSMLSA-N,"InChI=1S/C24H33NO5/c1-10(2)19(28)30-12-6-21(4)9-25-13-8-22-5-11(3)14-15(26)17(22)23(7-12,16(13)21)20(25)24(22,29)18(14)27/h10,12-18,20,26-27,29H,3,5-9H2,1-2,4H3/t12-,13-,14+,15+,16+,17+,18-,20-,21-,22+,23-,24-/m0/s1",C=C1C[C@@]23C[C@H]4[C@@H]5[C@@]6(C)C[C@H](OC(=O)C(C)C)C[C@@]57[C@@H]2[C@H](O)[C@@H]1[C@H](O)[C@]3(O)[C@H]7N4C6,C24H33NO5,pos_2MHNH3,415.235873156,BKHLAQWOXOLRLR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum coreanum,377294.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum coreanum'],6,3,7.5 5474,3320,693,Terpenoids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JAONFTKYPDCXJH-JNADDAEVSA-N,"InChI=1S/C24H33NO5/c1-9(2)20(28)30-19-13-15-22(4)6-5-7-23(15)16-14(26)11-8-12(17(23)25(13)21(22)29)24(16,19)18(27)10(11)3/h9,11-19,21,26-27,29H,3,5-8H2,1-2,4H3/t11-,12-,13-,14-,15-,16+,17-,18-,19-,21-,22+,23+,24+/m1/s1",C=C1[C@H]2C[C@@H]3[C@H]4N5[C@@H]6[C@@H]7[C@](C)(CCC[C@@]74[C@H]([C@@H]2O)[C@@]3([C@@H]1O)[C@@H]6OC(=O)C(C)C)[C@H]5O,C24H33NO5,pos_2MHNH3,415.235873156,JAONFTKYPDCXJH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ternatum,6131820.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium ternatum'],6,3,7.5 5475,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Aristolochia mollissima,656355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia mollissima'],4,1,5.431749761104584 5476,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,1,5.431749761104584 5477,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Platostoma palustre,285422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Platostoma'],['Platostoma chinense'],4,1,5.431749761104584 5478,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Spinacia oleracea,317784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Anserineae'],['Spinacia'],['Spinacia oleracea'],4,1,5.431749761104584 5479,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Olea europaea,23729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Oleeae'],['Olea'],['Olea europaea'],4,1,5.431749761104584 5480,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,1,5.431749761104584 5481,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Euchresta formosana,280933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Euchresta'],['Euchresta formosana'],4,1,5.431749761104584 5482,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Tapura fischeri,204812.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Dichapetalaceae'],['Unknown'],['Tapura'],['Tapura fischeri'],4,1,5.431749761104584 5483,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Saussurea medusa,474462.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea medusa'],4,1,5.431749761104584 5484,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Alloberberis fremontii,725518.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fremontii'],4,1,5.431749761104584 5485,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ophiorrhiza pumila,608350.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Ophiorrhizeae'],['Ophiorrhiza'],['Ophiorrhiza pumila'],4,1,5.431749761104584 5486,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliata,5503578.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifolia'],4,1,5.431749761104584 5487,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis trifoliolata,840498.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis trifoliolata'],4,1,5.431749761104584 5488,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Phellodendron chinense,710068.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Phellodendron'],['Phellodendron chinense'],4,1,5.431749761104584 5489,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ajuga taiwanensis,367347.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Ajuga'],['Ajuga taiwanensis'],4,1,5.431749761104584 5490,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Isotrema kaempferi,656366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia kaempferi'],4,1,5.431749761104584 5491,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Aristolochia kaempferi,656366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia kaempferi'],4,1,5.431749761104584 5492,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Centaurea malacitana,7613211.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Centaurea'],['Centaurea malacitana'],4,1,5.431749761104584 5493,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-RRNMINROSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Richardia grandiflora,3872538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Richardia'],['Richardia grandiflora'],4,1,5.431749761104584 5494,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-CQBRDPJOSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37-,41-,51+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Berberis fendleri,854435.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis fendleri'],4,1,5.431749761104584 5495,3318,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23293744,ISDB,FDHFJXKRMIVNCQ-OSIZZBRKSA-N,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,58,61H,1,14-25,27H2,2-12H3/b34-26+,44-28?,46-29?,47-30?,52-50?/t32-,33-,37+,41+,51-/m1/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(CC)=C1C,C55H74N4O5,,870.565921468,FDHFJXKRMIVNCQ,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ocimum labiatum,588789.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Ocimum'],['Ocimum labiatum'],4,1,5.431749761104584 5496,3313,1092,Carbohydrates,Saccharides,Disaccharides,0.45161813,ISDB,AQTKXCPRNZDOJU-SYHAXYEDSA-N,"InChI=1S/C9H18O8/c10-1-4(2-11)16-9-8(15)7(14)6(13)5(3-12)17-9/h4-15H,1-3H2/t5-,6-,7+,8-,9-/m1/s1",OCC(CO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C9H18O8,,254.100167536,AQTKXCPRNZDOJU,Carbohydrates,Saccharides,Disaccharides,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.306472539901733 5497,3313,1092,Carbohydrates,Saccharides,Disaccharides,0.45161813,ISDB,AQTKXCPRNZDOJU-UHFFFAOYSA-N,"InChI=1S/C9H18O8/c10-1-4(2-11)16-9-8(15)7(14)6(13)5(3-12)17-9/h4-15H,1-3H2",OCC(CO)OC1OC(CO)C(O)C(O)C1O,C9H18O8,,254.100167536,AQTKXCPRNZDOJU,Carbohydrates,Saccharides,Disaccharides,Arabidopsis,309275.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Unknown'],4,3,7.306472539901733 5498,3313,1092,Carbohydrates,Saccharides,Disaccharides,0.45161813,ISDB,AQTKXCPRNZDOJU-SYHAXYEDSA-N,"InChI=1S/C9H18O8/c10-1-4(2-11)16-9-8(15)7(14)6(13)5(3-12)17-9/h4-15H,1-3H2/t5-,6-,7+,8-,9-/m1/s1",OCC(CO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C9H18O8,,254.100167536,AQTKXCPRNZDOJU,Carbohydrates,Saccharides,Disaccharides,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,3,7.306472539901733 5499,3308,-1,,,,0.614978,ISDB,QUHIFZVMNSLMAB-ZEBSVQATSA-N,"InChI=1S/C15H23ClO5/c1-12(2)10(16)7(17)5-13(3)9(11(18)19)14(4,20)6-8-15(12,13)21-8/h7-10,17,20H,5-6H2,1-4H3,(H,18,19)/t7-,8-,9+,10-,13+,14+,15+/m0/s1",CC1(C)[C@@H](Cl)[C@@H](O)C[C@]2(C)[C@@H](C(=O)O)[C@](C)(O)C[C@@H]3O[C@]312,C15H23ClO5,,318.123401516,QUHIFZVMNSLMAB,Terpenoids,Sesquiterpenoids,Brasilane sesquiterpenoids,Adenocarpus foliolosus,834501.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Genisteae'],['Adenocarpus'],['Adenocarpus foliolosus'],4,0,6.459912061691284 5500,3307,-1,,,,0.26590207,ISDB,DLPOANDLVJHGGA-SSDOTTSWSA-N,"InChI=1S/C10H10N2O2/c11-10(14)7-5-9(13)12-8-4-2-1-3-6(7)8/h1-4,7H,5H2,(H2,11,14)(H,12,13)/t7-/m1/s1",NC(=O)[C@@H]1CC(=O)Nc2ccccc21,C10H10N2O2,,190.07422756,DLPOANDLVJHGGA,Alkaloids,,,Isatis tinctoria,631500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Isatideae'],['Isatis'],['Isatis tinctoria'],4,0,5.063608288764954 5501,3305,-1,,,,0.0,MS1_match,XHUBSJRBOQIZNI-UHFFFAOYSA-N,"InChI=1S/C9H12O3/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,10-11H,4-5H2,1H3",COc1cc(CCO)ccc1O,C9H12O3,pos_1_1proton1acetonitrile,168.078644244,XHUBSJRBOQIZNI,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 5502,3305,-1,,,,0.0,MS1_match,BNWJOHGLIBDBOB-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3",C=CCc1cc(OC)c2c(c1)OCO2,C11H12O3,pos_1_1proton1ammonium,192.078644244,BNWJOHGLIBDBOB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 5503,3303,-1,,,,0.0,MS1_match,QBYSXERNIGFSBS-UHFFFAOYSA-N,"InChI=1S/C22H32O14/c1-2-8-9-3-4-31-19(30)10(9)7-32-20(8)36-22-17(29)18(14(26)12(6-24)34-22)35-21-16(28)15(27)13(25)11(5-23)33-21/h2,7-9,11-18,20-29H,1,3-6H2",C=CC1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)OC=C2C(=O)OCCC21,C22H32O14,pos_2_2sodium,520.179205704,QBYSXERNIGFSBS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 5504,3303,-1,,,,0.0,MS1_match,QBYSXERNIGFSBS-UHFFFAOYSA-N,"InChI=1S/C22H32O14/c1-2-8-9-3-4-31-19(30)10(9)7-32-20(8)36-22-17(29)18(14(26)12(6-24)34-22)35-21-16(28)15(27)13(25)11(5-23)33-21/h2,7-9,11-18,20-29H,1,3-6H2",C=CC1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)OC=C2C(=O)OCCC21,C22H32O14,pos_2_2sodium,520.179205704,QBYSXERNIGFSBS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 5505,3301,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,KENJGROHBQKVPH-ODZPGRJLSA-N,"InChI=1S/C21H31NO5/c1-3-22-9-19(2)6-5-12(23)21-11-8-10-4-7-20(26,13(11)18(25)27-10)14(17(21)22)15(24)16(19)21/h10-17,23-24,26H,3-9H2,1-2H3/t10-,11-,12+,13-,14+,15-,16-,17-,19+,20-,21+/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6CC[C@](O)([C@@H]([C@@H](O)[C@H]23)[C@@H]14)[C@H]5C(=O)O6,C21H31NO5,pos_2MHNH3,377.220223092,KENJGROHBQKVPH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum heterophyllum,124446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum heterophyllum'],6,0,6.0 5506,3296,646,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.49657667,ISDB,DKGYTSKPMLWLEI-FIZOKRMRSA-N,"InChI=1S/C10H14O4/c1-5-2-3-6-7(9(11)12)4-14-10(13)8(5)6/h4-6,8,10,13H,2-3H2,1H3,(H,11,12)/t5-,6+,8+,10+/m0/s1",C[C@H]1CC[C@@H]2C(C(=O)O)=CO[C@@H](O)[C@@H]21,C10H14O4,,198.089208928,DKGYTSKPMLWLEI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,10.48630666732788 5507,3294,784,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,0.9520286,ISDB,,,,,,,YVCSXKPTXFIUHA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.8081142902374268 5508,3293,1639,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.633109,ISDB,FUGYGGDSWSUORM-UHFFFAOYSA-N,"InChI=1S/C8H8O/c1-2-7-3-5-8(9)6-4-7/h2-6,9H,1H2",C=Cc1ccc(O)cc1,C8H8O,,120.057514876,FUGYGGDSWSUORM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Papaver somniferum,438118.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Papaver'],['Papaver somniferum'],5,3,9.032435894012451 5509,3290,367,Terpenoids,Steroids,Stigmastane steroids,0.0,MS1_match,VWDLOXMZIGUBKM-AUGXRQBFSA-N,"InChI=1S/C35H58O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h8-10,20-22,24-33,36-39H,7,11-19H2,1-6H3/b9-8+/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H58O6,pos_1_1sodium1acetonitrile,574.423339576,VWDLOXMZIGUBKM,Terpenoids,Steroids,Stigmastane steroids,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,3,8.5 5510,3290,367,Terpenoids,Steroids,Stigmastane steroids,0.0,MS1_match,VWDLOXMZIGUBKM-AUGXRQBFSA-N,"InChI=1S/C35H58O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h8-10,20-22,24-33,36-39H,7,11-19H2,1-6H3/b9-8+/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H58O6,pos_1_1sodium1acetonitrile,574.423339576,VWDLOXMZIGUBKM,Terpenoids,Steroids,Stigmastane steroids,Eriocapitella tomentosa,5737682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tomentosa'],7,3,8.5 5511,3287,-1,,,,0.56122166,ISDB,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,8.244886636734009 5512,3273,-1,,,,0.0,MS1_match,RODXRVNMMDRFIK-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3",COc1cc2ccc(=O)oc2cc1O,C10H8O4,pos_2MNa,192.042258736,RODXRVNMMDRFIK,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Lonicera hypoleuca,5746397.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoleuca'],7,0,7.0 5513,3273,-1,,,,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1potassium,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 5514,3273,-1,,,,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1potassium,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 5515,3273,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1potassium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 5516,3273,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1potassium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5517,3273,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1potassium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 5518,3273,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1potassium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5519,3272,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Lonicera hypoleuca,5746397.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoleuca'],7,1,7.5 5520,3272,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Lonicera hypoleuca,5746397.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoleuca'],7,1,7.5 5521,3272,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,NPJICTMALKLTFW-OFUAXYCQSA-N,"InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C35H60O6,pos_1_1potassium,576.43898964,NPJICTMALKLTFW,Terpenoids,Steroids,Stigmastane steroids,Lonicera hypoleuca,5746397.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoleuca'],7,1,7.5 5522,3266,-1,,,,0.0,MS1_match,KNFOHFRALRKTOJ-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 5523,3266,-1,,,,0.0,MS1_match,KNFOHFRALRKTOJ-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc(C[C@@H]2CO[C@@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 5524,3266,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 5525,3266,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 5526,3266,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 5527,3266,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 5528,3263,-1,,,,0.0,MS1_match,ZGLXUQQMLLIKAN-SVIJTADQSA-N,"InChI=1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3/t13-,19+,20-/m0/s1",COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,C22H22O7,pos_1_1proton1methanol,398.136553044,ZGLXUQQMLLIKAN,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 5529,3263,-1,,,,0.0,MS1_match,ZGLXUQQMLLIKAN-SVIJTADQSA-N,"InChI=1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3/t13-,19+,20-/m0/s1",COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC,C22H22O7,pos_1_1proton1methanol,398.136553044,ZGLXUQQMLLIKAN,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 5530,3261,344,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Chromones,0.6948411,ISDB,FSJZBVKUSMMYDT-ZZRRTNHHSA-N,"InChI=1S/C21H22O11/c22-11-3-5-15(14(25)8-11)31-21-20(29)19(28)18(27)16(32-21)9-30-17(26)6-2-10-1-4-12(23)13(24)7-10/h1-8,16,18-25,27-29H,9H2/b6-2+/t16-,18-,19+,20-,21-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2ccc(O)cc2O)[C@H](O)[C@@H](O)[C@@H]1O,C21H22O11,,450.116211524,FSJZBVKUSMMYDT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Vaccinium dunalianum,348403.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Vaccinieae'],['Vaccinium'],['Vaccinium dunalianum'],4,2,7.779364347457886 5531,3260,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.32027084,ISDB,GUAHPAJOXVYFON-UHFFFAOYSA-N,"InChI=1S/C9H17NO3/c1-7(10)8(11)5-3-2-4-6-9(12)13/h7H,2-6,10H2,1H3,(H,12,13)",CC(N)C(=O)CCCCCC(=O)O,C9H17NO3,,187.120843404,GUAHPAJOXVYFON,Amino acids and Peptides,Small peptides,Aminoacids,Phycomyces blakesleeanus,735973.0,['Eukaryota'],['Fungi'],['Unknown'],['Mucoromycetes'],['Mucorales'],['Phycomycetaceae'],['Unknown'],['Phycomyces'],['Phycomyces blakesleeanus'],1,0,2.281083345413208 5532,3260,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.32027084,ISDB,GUAHPAJOXVYFON-UHFFFAOYSA-N,"InChI=1S/C9H17NO3/c1-7(10)8(11)5-3-2-4-6-9(12)13/h7H,2-6,10H2,1H3,(H,12,13)",CC(N)C(=O)CCCCCC(=O)O,C9H17NO3,,187.120843404,GUAHPAJOXVYFON,Amino acids and Peptides,Small peptides,Aminoacids,Apis cerana,625771.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Apidae'],['Apini'],['Apis'],['Apis cerana'],1,0,2.281083345413208 5533,3260,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.32027084,ISDB,GUAHPAJOXVYFON-UHFFFAOYSA-N,"InChI=1S/C9H17NO3/c1-7(10)8(11)5-3-2-4-6-9(12)13/h7H,2-6,10H2,1H3,(H,12,13)",CC(N)C(=O)CCCCCC(=O)O,C9H17NO3,,187.120843404,GUAHPAJOXVYFON,Amino acids and Peptides,Small peptides,Aminoacids,Leishmania donovani,766598.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Leishmania'],['Leishmania donovani'],1,0,2.281083345413208 5534,3260,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.32027084,ISDB,GUAHPAJOXVYFON-UHFFFAOYSA-N,"InChI=1S/C9H17NO3/c1-7(10)8(11)5-3-2-4-6-9(12)13/h7H,2-6,10H2,1H3,(H,12,13)",CC(N)C(=O)CCCCCC(=O)O,C9H17NO3,,187.120843404,GUAHPAJOXVYFON,Amino acids and Peptides,Small peptides,Aminoacids,Ailuropoda melanoleuca,872573.0,['Eukaryota'],['Metazoa'],['Chordata'],['Mammalia'],['Carnivora'],['Ursidae'],['Unknown'],['Ailuropoda'],['Ailuropoda melanoleuca'],1,0,2.281083345413208 5535,3258,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.84848636,ISDB,OIIJXQMSEYQDDI-UHFFFAOYSA-N,"InChI=1S/C13H18/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h7-8,10H,4-6H2,1-3H3",Cc1ccc(C)c2c1CCCC2C,C13H18,,174.140850576,OIIJXQMSEYQDDI,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.893945455551147 5536,3256,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.28324166,ISDB,JAYIAMKATBCOIA-PRTUSXBOSA-N,"InChI=1S/C12H16O5/c1-4-7-8-5-6-16-10(13)9(8)12(15-3)17-11(7)14-2/h4,11-12H,5-6H2,1-3H3/b7-4-/t11-,12+/m0/s1",C/C=C1/C2=C(C(=O)OCC2)[C@H](OC)O[C@@H]1OC,C12H16O5,,240.099773612,JAYIAMKATBCOIA,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Fagraea gracilipes,470786.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Potalieae'],['Fagraea'],['Fagraea gracilipes'],4,2,6.132966637611389 5537,3256,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.28324166,ISDB,JAYIAMKATBCOIA-HIMAVIEDSA-N,"InChI=1S/C12H16O5/c1-4-7-8-5-6-16-10(13)9(8)12(15-3)17-11(7)14-2/h4,11-12H,5-6H2,1-3H3/b7-4-/t11-,12+/m1/s1",C/C=C1/C2=C(C(=O)OCC2)[C@@H](OC)O[C@H]1OC,C12H16O5,,240.099773612,JAYIAMKATBCOIA,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Gentiana macrophylla,615941.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Gentiana'],['Gentiana macrophylla'],4,2,6.132966637611389 5538,3253,-1,,,,0.0,MS1_match,CRSFLLTWRCYNNX-QBNNUVSCSA-N,"InChI=1S/C16H18O10/c1-23-7-4-6-2-3-9(18)25-14(6)15(11(7)20)26-16-13(22)12(21)10(19)8(5-17)24-16/h2-4,8,10,12-13,16-17,19-22H,5H2,1H3/t8-,10-,12+,13-,16+/m1/s1",COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O,C16H18O10,pos_1_1potassium,370.0899967759999,CRSFLLTWRCYNNX,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 5539,3253,-1,,,,0.0,MS1_match,CRSFLLTWRCYNNX-QBNNUVSCSA-N,"InChI=1S/C16H18O10/c1-23-7-4-6-2-3-9(18)25-14(6)15(11(7)20)26-16-13(22)12(21)10(19)8(5-17)24-16/h2-4,8,10,12-13,16-17,19-22H,5H2,1H3/t8-,10-,12+,13-,16+/m1/s1",COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O,C16H18O10,pos_1_1potassium,370.0899967759999,CRSFLLTWRCYNNX,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 5540,3249,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.69527566,ISDB,SDMADMBVKYOYQN-UHFFFAOYSA-N,"InChI=1S/C26H26O12/c1-36-20-11-15(3-7-17(20)28)5-8-22(31)37-21-13-26(35,25(33)34)12-19(30)24(21)38-23(32)9-4-14-2-6-16(27)18(29)10-14/h2-11,19,21,24,27-30,35H,12-13H2,1H3,(H,33,34)",COc1cc(C=CC(=O)OC2CC(O)(C(=O)O)CC(O)C2OC(=O)C=Cc2ccc(O)c(O)c2)ccc1O,C26H26O12,,530.1424262719999,SDMADMBVKYOYQN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Artemisia annua,637444.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia annua'],4,3,8.281102657318115 5541,3249,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.69527566,ISDB,SDMADMBVKYOYQN-KBIVDKRSSA-N,"InChI=1S/C26H26O12/c1-36-20-11-15(3-7-17(20)28)5-8-22(31)37-21-13-26(35,25(33)34)12-19(30)24(21)38-23(32)9-4-14-2-6-16(27)18(29)10-14/h2-11,19,21,24,27-30,35H,12-13H2,1H3,(H,33,34)/b8-5+,9-4+/t19-,21-,24+,26-/m0/s1",COc1cc(/C=C/C(=O)O[C@H]2C[C@](O)(C(=O)O)C[C@H](O)[C@H]2OC(=O)/C=C/c2ccc(O)c(O)c2)ccc1O,C26H26O12,,530.142426272,SDMADMBVKYOYQN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Coffea canephora,104739.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Coffea'],['Coffea canephora'],4,3,8.281102657318115 5542,3244,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.60752153,ISDB,BWBYOMWIDCKMAI-LNMZYWNMSA-N,"InChI=1S/C12H18O9/c1-5(14)12(18)2-6(4-19-12)20-11-10(17)9(16)8(15)7(3-13)21-11/h2,7-11,13,15-18H,3-4H2,1H3/t7-,8-,9+,10-,11-,12?/m1/s1",CC(=O)C1(O)C=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CO1,C12H18O9,,306.095082156,BWBYOMWIDCKMAI,,,,Penicillium citrinum,226488.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium citrinum'],1,0,3.430086135864258 5543,3243,-1,,,,0.0,MS1_match,ZYGHJZDHTFUPRJ-UHFFFAOYSA-N,InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,O=c1ccc2ccccc2o1,C9H6O2,pos_1_1proton,146.036779432,ZYGHJZDHTFUPRJ,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,0,6.0 5544,3242,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_2MH,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,1,6.5 5545,3242,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,WKOLLVMJNQIZCI-UHFFFAOYSA-N,"InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)",COc1cc(C(=O)O)ccc1O,C8H8O4,pos_2MH,168.042258736,WKOLLVMJNQIZCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,1,6.5 5546,3240,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.28486645,ISDB,HKMDHBXRMZEVHY-UHFFFAOYSA-N,"InChI=1S/C16H26O8/c1-7-8-3-4-16(2,9(8)6-22-14(7)21)24-15-13(20)12(19)11(18)10(5-17)23-15/h7-13,15,17-20H,3-6H2,1-2H3",CC1C(=O)OCC2C1CCC2(C)OC1OC(CO)C(O)C(O)C1O,C16H26O8,,346.1627677919999,HKMDHBXRMZEVHY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,8.639465808868408 5547,3239,-1,,,,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_2MNa,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 5548,3236,523,Fatty acids,Fatty amides,N-acyl amines,0.65364414,ISDB,ZNXZGRMVNNHPCA-VIFPVBQESA-N,"InChI=1S/C11H22N2O4S/c1-11(2,7-14)9(16)10(17)13-4-3-8(15)12-5-6-18/h9,14,16,18H,3-7H2,1-2H3,(H,12,15)(H,13,17)/t9-/m0/s1",CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)NCCS,C11H22N2O4S,,278.130028184,ZNXZGRMVNNHPCA,Fatty acids,Fatty amides,N-acyl amines,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,3,8.114576578140259 5549,3234,710,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 5550,3234,710,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5551,3234,710,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 5552,3234,710,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 5553,3234,710,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5554,3234,710,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 5555,3233,-1,,,,0.30251583,ISDB,CHZSVNLGISWUMU-NFAFBBCCSA-N,"InChI=1S/C29H34O11/c1-23-10-18-25(3)29-19(23)20(31)28(40-29,36-11-15(23)21(32)37-18)14-8-17-27(38-17)9-12(35-4)7-16(30)24(27,2)13(14)5-6-26(29,34)22(33)39-25/h12-15,17-19,34H,5-11H2,1-4H3/t12-,13+,14-,15+,17-,18-,19+,23-,24+,25+,26-,27-,28-,29+/m1/s1",CO[C@@H]1CC(=O)[C@]2(C)[C@H]3CC[C@@]4(O)C(=O)O[C@@]5(C)[C@H]6C[C@]7(C)[C@@H](CO[C@@]8(O[C@]45[C@H]7C8=O)[C@@H]3C[C@H]3O[C@]32C1)C(=O)O6,C29H34O11,,558.210111908,CHZSVNLGISWUMU,Terpenoids,Steroids,Ergostane steroids,Physalis angulata,12537.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Physaleae'],['Physalis'],['Physalis angulata'],4,0,5.210063338279724 5556,3232,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5557,3232,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 5558,3232,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 5559,3232,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 5560,3232,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 5561,3232,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5562,3230,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.744287,ISDB,KZYVOZABVXLALY-UHFFFAOYSA-N,"InChI=1S/C9H12O2/c1-3-4-7-6(2)8(10)5-9(7)11/h3,8,10H,1,4-5H2,2H3",C=CCC1=C(C)C(O)CC1=O,C9H12O2,,152.083729624,KZYVOZABVXLALY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Zanthoxylum simulans,889927.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum simulans'],4,2,7.977148056030273 5563,3228,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,UEEFSWPSRLSUQJ-NOMYRAODSA-N,"InChI=1S/C25H31NO11/c1-2-15-16(8-7-14-5-3-9-26(11-14)10-4-6-19(28)29)17(23(33)34)13-35-24(15)37-25-22(32)21(31)20(30)18(12-27)36-25/h2-3,5,7-9,11,13,15-16,18,20-22,24-25,27,30-32H,1,4,6,10,12H2,(H-,28,29,33,34)/b8-7+/t15-,16+,18-,20-,21+,22-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCCC(=O)O)c1,C25H31NO11,pos_1_1proton1methanol,521.1897108119997,UEEFSWPSRLSUQJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5564,3228,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QGCICTMJHHIGBT-LSWTWQANSA-N,"InChI=1S/C25H31NO11/c1-4-15-16(7-6-13-8-14(22(31)32)10-26(5-2)9-13)17(23(33)34-3)12-35-24(15)37-25-21(30)20(29)19(28)18(11-27)36-25/h4,6-10,12,15-16,18-21,24-25,27-30H,1,5,11H2,2-3H3/b7-6+/t15-,16+,18-,19-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)[O-])c[n+](CC)c1,C25H31NO11,pos_1_1proton1methanol,521.1897108119998,QGCICTMJHHIGBT,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5565,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,3,9.992650508880615 5566,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Gymnosporia montana,5513373.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia montana'],6,3,9.992650508880615 5567,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-SWLSCSKDSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Maytenus disticha,418523.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus disticha'],6,3,9.992650508880615 5568,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,3,9.992650508880615 5569,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Salacia reticulata,5750051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia reticulata'],6,3,9.992650508880615 5570,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-UHFFFAOYSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2",Oc1cc(O)c2c(c1)OC(c1cc(O)c(O)c(O)c1)C(O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,3,9.992650508880615 5571,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-SWLSCSKDSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Celastrus flagellaris,709260.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus flagellaris'],6,3,9.992650508880615 5572,3227,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6231626,ISDB,XMOCLSLCDHWDHP-IUODEOHRSA-N,"InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@H](O)C2,C15H14O7,,306.073952788,XMOCLSLCDHWDHP,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,3,9.992650508880615 5573,3225,383,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5078557,ISDB,FGIRFSQAJATKED-NBYNOWDBSA-N,"InChI=1S/C17H26O7/c1-10(3-4-11-5-7-12(22-2)8-6-11)23-17-16(21)15(20)14(19)13(9-18)24-17/h5-8,10,13-21H,3-4,9H2,1-2H3/t10-,13-,14-,15+,16-,17-/m1/s1",COc1ccc(CC[C@@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C17H26O7,,342.167853172,FGIRFSQAJATKED,,,,Abies spectabilis,844776.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Unknown'],['Pinales'],['Pinaceae'],['Unknown'],['Abies'],['Abies spectabilis'],3,0,5.031422853469849 5574,3220,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.45196688,ISDB,DPBCFTHDJGXWRI-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(19)16(2,14(7)23-5-8(6)18)25-15-13(22)12(21)11(20)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,,362.157682412,DPBCFTHDJGXWRI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,9.307867527008057 5575,3217,1153,Polyketides,Cyclic polyketides,Chromones,0.3400775,ISDB,JWUYCQNPNLREFR-XBURVNOZSA-N,"InChI=1S/C13H18O6/c1-5-7(2)12(16)19-10-8(14)6-9(18-4)13(3,17)11(10)15/h6-7,10,17H,5H2,1-4H3/t7-,10-,13-/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1C(=O)C=C(OC)[C@@](C)(O)C1=O,C13H18O6,,270.110338296,JWUYCQNPNLREFR,Polyketides,Cyclic polyketides,Simple cyclic polyketides,Aspergillus flavus,188996.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus flavus'],1,2,3.3603099584579468 5576,3215,155,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,MIQIFBIWUBAPTB-KJQQCQNYSA-N,"InChI=1S/C42H58N2O/c1-36-8-5-9-42-32(36)7-11-39-21-40(25(16-33(39)42)15-30(39)34(42)44(4)23-36)12-13-41-29-17-28-26-14-24-18-37(2,22-43(3)20-24)27(26)6-10-38(28,19-31(29)41)35(41)45-40/h17,24-25,29-35H,5-16,18-23H2,1-4H3/t24?,25-,29+,30?,31?,32+,33+,34?,35-,36-,37-,38+,39+,40-,41+,42-/m0/s1",CN1CC2CC3=C(CC[C@@]45CC6[C@@H](C=C34)[C@]63CC[C@@]4(C[C@]67CC[C@@H]8[C@@]9(C)CCC[C@]8%10C(C6C[C@H]4C[C@H]7%10)N(C)C9)O[C@@H]53)[C@@](C)(C2)C1,C42H58N2O,pos_2_2sodium,606.454914476,MIQIFBIWUBAPTB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 5577,3215,155,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,MIQIFBIWUBAPTB-KJQQCQNYSA-N,"InChI=1S/C42H58N2O/c1-36-8-5-9-42-32(36)7-11-39-21-40(25(16-33(39)42)15-30(39)34(42)44(4)23-36)12-13-41-29-17-28-26-14-24-18-37(2,22-43(3)20-24)27(26)6-10-38(28,19-31(29)41)35(41)45-40/h17,24-25,29-35H,5-16,18-23H2,1-4H3/t24?,25-,29+,30?,31?,32+,33+,34?,35-,36-,37-,38+,39+,40-,41+,42-/m0/s1",CN1CC2CC3=C(CC[C@@]45CC6[C@@H](C=C34)[C@]63CC[C@@]4(C[C@]67CC[C@@H]8[C@@]9(C)CCC[C@]8%10C(C6C[C@H]4C[C@H]7%10)N(C)C9)O[C@@H]53)[C@@](C)(C2)C1,C42H58N2O,pos_2_2sodium,606.454914476,MIQIFBIWUBAPTB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 5578,3213,1153,Polyketides,Cyclic polyketides,Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 5579,3213,1153,Polyketides,Cyclic polyketides,Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 5580,3213,1153,Polyketides,Cyclic polyketides,Chromones,0.0,MS1_match,PBHOYFHVNTVOLB-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(8-30-21-19(29)18(28)17(27)15(7-23)32-21)2-3-11-12(24)5-14(26)16-13(25)4-10(6-22)31-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,PBHOYFHVNTVOLB,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 5581,3213,1153,Polyketides,Cyclic polyketides,Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,3,7.5 5582,3213,1153,Polyketides,Cyclic polyketides,Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton1acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 5583,3209,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1potassium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 5584,3209,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1potassium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,0,8.0 5585,3208,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.64562577,ISDB,USMNOWBWPHYOEA-MRTMQBJTSA-N,"InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1",CC(C)[C@]12CC(=O)[C@H](C)[C@H]1C2,C10H16O,,152.120115132,USMNOWBWPHYOEA,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,2,9.582503080368042 5586,3207,-1,,,,0.0,MS1_match,RKMQRPYLPSKVNS-UHFFFAOYSA-N,"InChI=1S/C6H10O4/c1-10-6(9)3-2-5(8)4-7/h7H,2-4H2,1H3",COC(=O)CCC(=O)CO,C6H10O4,pos_2MHNH3,146.0579088,RKMQRPYLPSKVNS,Fatty acids,Fatty Acids and Conjugates,,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 5587,3205,109,Terpenoids,Diterpenoids,Estrane steroids,0.59686774,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.887470960617065 5588,3204,-1,,,,0.30978844,ISDB,PYLNOJGNKMCWPS-SEUBVADGSA-N,"InChI=1S/C30H47NO7S/c1-19(2)26(27(33)34)31-17-20(16-25(31)32)8-10-22-21(18-38-39(35,36)37)9-11-24-29(22,5)15-12-23-28(3,4)13-7-14-30(23,24)6/h16,18-19,22-24,26H,7-15,17H2,1-6H3,(H,33,34)(H,35,36,37)/b21-18+/t22-,23-,24-,26-,29+,30-/m0/s1",CC(C)[C@@H](C(=O)O)N1CC(CC[C@H]2/C(=C/OS(=O)(=O)O)CC[C@H]3[C@]2(C)CC[C@H]2C(C)(C)CCC[C@]32C)=CC1=O,C30H47NO7S,,565.307323844,PYLNOJGNKMCWPS,Terpenoids,Sesterterpenoids,Cheilanthane sesterterpenoids,Coscinoderma,165941.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Dictyoceratida'],['Spongiidae'],['Unknown'],['Coscinoderma'],['Unknown'],1,0,2.239153742790222 5589,3202,-1,,,,0.0,MS1_match,JOZKFWLRHCDGJA-LLVKDONJSA-N,"InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3/t11-/m1/s1",CC(=O)OCC[C@H](C)CCC=C(C)C,C12H22O2,pos_2MHNH3,198.161979944,JOZKFWLRHCDGJA,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5590,3199,479,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,0.5281809,ISDB,,,,,,,DBELLPBYTZDJHZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.1127235889434814 5591,3197,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-UHFFFAOYSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)",O=C(O)C=Cc1ccc(O)c(O)c1,C9H8O4,pos_1_1proton,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 5592,3197,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,3,9.5 5593,3196,557,Alkaloids,Pseudoalkaloids,Cyanogenic glycosides,0.22461525,ISDB,KZBHGKPXLHDZDW-ORRFLJAUSA-N,"InChI=1S/C25H31NO12/c1-34-17-9-12(3-5-14(17)28)4-6-19(30)38-24-22(33)21(32)18(11-27)37-25(24)36-16-10-15(29)23(35-2)20(31)13(16)7-8-26/h3-7,9,15-16,18,20-25,27-29,31-33H,10-11H2,1-2H3/b6-4+,13-7+/t15-,16+,18+,20-,21+,22-,23-,24+,25+/m0/s1",COc1cc(/C=C/C(=O)O[C@H]2[C@H](O[C@@H]3C[C@H](O)[C@H](OC)[C@@H](O)/C3=C/C#N)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1O,C25H31NO12,,537.184625432,KZBHGKPXLHDZDW,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Simmondsia chinensis,864011.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Simmondsiaceae'],['Unknown'],['Simmondsia'],['Simmondsia chinensis'],4,3,6.3984609842300415 5594,3192,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.29509446,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Corbicula sandai,920655.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Venerida'],['Cyrenidae'],['Unknown'],['Corbicula'],['Corbicula sandai'],1,3,3.6803778409957886 5595,3192,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.29509446,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Magallana gigas,987409.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Ostreida'],['Ostreidae'],['Unknown'],['Magallana'],['Magallana gigas'],1,3,3.6803778409957886 5596,3192,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.29509446,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Corbicula japonica,920654.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Venerida'],['Cyrenidae'],['Unknown'],['Corbicula'],['Corbicula japonica'],1,3,3.6803778409957886 5597,3192,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.29509446,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Crassostrea gigas,987409.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Ostreida'],['Ostreidae'],['Unknown'],['Magallana'],['Magallana gigas'],1,3,3.6803778409957886 5598,3191,886,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.5372205,ISDB,DIGNKQFJIIKEBA-RKQHYHRCSA-N,"InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-5-4-8-2-1-3-9(16)6-8/h1-3,6,10-19H,4-5,7H2/t10-,11-,12+,13-,14-/m1/s1",OC[C@H]1O[C@@H](OCCc2cccc(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C14H20O7,,300.12090298,DIGNKQFJIIKEBA,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Sambucus nigra,1042130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Sambucus'],['Sambucus nigra'],5,3,8.648881912231445 5599,3190,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.6953181,ISDB,KVRQQFBSAHPTAB-ATLLRHMBSA-N,"InChI=1S/C11H18O9/c1-4(5(14)2-12)10(18)20-11-9(17)8(16)7(15)6(3-13)19-11/h5-9,11-17H,1-3H2/t5-,6-,7-,8+,9-,11+/m1/s1",C=C(C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C11H18O9,,294.095082156,KVRQQFBSAHPTAB,Fatty acids,Fatty acyl glycosides,Fatty acyl glycosides of mono- and disaccharides,Tulipa gesneriana,878707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Tulipa'],['Tulipa gesneriana'],4,0,6.7812724113464355 5600,3189,174,Terpenoids,Apocarotenoids,Megastigmanes,0.51443917,ISDB,HNZUNIKWNYHEJJ-FMIVXFBMSA-N,"InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+",CC(=O)CC/C=C(\C)CCC=C(C)C,C13H22O,,194.167065324,HNZUNIKWNYHEJJ,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,10.057756662368774 5601,3186,-1,,,,0.0,MS1_match,HSUIVCLOAAJSRE-UHFFFAOYSA-N,"InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3",COCCOC(=O)c1ccccc1C(=O)OCCOC,C14H18O6,pos_1_sodium,282.110338296,HSUIVCLOAAJSRE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5602,3183,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.54685026,ISDB,QSGZRCKKGZPIIZ-RPXSYWBFSA-N,"InChI=1S/C21H38O11/c1-11(5-4-7-21(2,3)28)6-8-29-20-18(27)16(25)15(24)13(32-20)10-31-19-17(26)14(23)12(22)9-30-19/h6,12-20,22-28H,4-5,7-10H2,1-3H3/b11-6+/t12-,13+,14+,15+,16-,17+,18+,19-,20+/m0/s1",C/C(=C\CO[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CCCC(C)(C)O,C21H38O11,,466.241412036,QSGZRCKKGZPIIZ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Rhodiola rosea,914930.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Crassulaceae'],['Unknown'],['Rhodiola'],['Rhodiola rosea'],4,2,7.187401056289673 5603,3183,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.54685026,ISDB,QSGZRCKKGZPIIZ-RPXSYWBFSA-N,"InChI=1S/C21H38O11/c1-11(5-4-7-21(2,3)28)6-8-29-20-18(27)16(25)15(24)13(32-20)10-31-19-17(26)14(23)12(22)9-30-19/h6,12-20,22-28H,4-5,7-10H2,1-3H3/b11-6+/t12-,13+,14+,15+,16-,17+,18+,19-,20+/m0/s1",C/C(=C\CO[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CCCC(C)(C)O,C21H38O11,,466.241412036,QSGZRCKKGZPIIZ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Rhodiola sachalinensis,581648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Crassulaceae'],['Unknown'],['Rhodiola'],['Rhodiola sachalinensis'],4,2,7.187401056289673 5604,3183,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.54685026,ISDB,QSGZRCKKGZPIIZ-UHFFFAOYSA-N,"InChI=1S/C21H38O11/c1-11(5-4-7-21(2,3)28)6-8-29-20-18(27)16(25)15(24)13(32-20)10-31-19-17(26)14(23)12(22)9-30-19/h6,12-20,22-28H,4-5,7-10H2,1-3H3",CC(=CCOC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)CCCC(C)(C)O,C21H38O11,,466.241412036,QSGZRCKKGZPIIZ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Rhodiola crenulata,1024602.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Crassulaceae'],['Unknown'],['Rhodiola'],['Rhodiola crenulata'],4,2,7.187401056289673 5605,3182,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,ILEDWLMCKZNDJK-UHFFFAOYSA-N,"InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H",O=c1ccc2cc(O)c(O)cc2o1,C9H6O4,pos_1_1proton1methanol,178.026608672,ILEDWLMCKZNDJK,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 5606,3172,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.52839416,ISDB,PSQYTAPXSHCGMF-BQYQJAHWSA-N,"InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+",CC(=O)/C=C/C1=C(C)CCCC1(C)C,C13H20O,,192.15141526,PSQYTAPXSHCGMF,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,8.613576650619507 5607,3171,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton1acetonitrile,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 5608,3171,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton1acetonitrile,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 5609,3171,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton1acetonitrile,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 5610,3171,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton1acetonitrile,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5611,3171,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton1acetonitrile,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 5612,3171,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton1acetonitrile,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5613,3160,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_2MHNH3,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 5614,3160,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_2MHNH3,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 5615,3160,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_2MHNH3,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 5616,3158,-1,,,,0.0,MS1_match,QBYSXERNIGFSBS-UHFFFAOYSA-N,"InChI=1S/C22H32O14/c1-2-8-9-3-4-31-19(30)10(9)7-32-20(8)36-22-17(29)18(14(26)12(6-24)34-22)35-21-16(28)15(27)13(25)11(5-23)33-21/h2,7-9,11-18,20-29H,1,3-6H2",C=CC1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)OC=C2C(=O)OCCC21,C22H32O14,pos_1_1potassium,520.179205704,QBYSXERNIGFSBS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 5617,3158,-1,,,,0.0,MS1_match,QBYSXERNIGFSBS-UHFFFAOYSA-N,"InChI=1S/C22H32O14/c1-2-8-9-3-4-31-19(30)10(9)7-32-20(8)36-22-17(29)18(14(26)12(6-24)34-22)35-21-16(28)15(27)13(25)11(5-23)33-21/h2,7-9,11-18,20-29H,1,3-6H2",C=CC1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)OC=C2C(=O)OCCC21,C22H32O14,pos_1_1potassium,520.179205704,QBYSXERNIGFSBS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 5618,3152,861,Shikimates and Phenylpropanoids,Aromatic polyketides,Griseofulvins,0.5045677,ISDB,ITENTBHADJNDDH-DJTMHQFBSA-N,"InChI=1S/C16H16O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,19,21,24H,6-7H2,(H,22,23)/b4-2-/t11-,12-,14+,16-/m1/s1",O=C(/C=C\C1=CC(=O)C(=O)C=C1)O[C@@H]1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,C16H16O9,,352.079432092,ITENTBHADJNDDH,Shikimates and Phenylpropanoids,,,Cynara cardunculus,991885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Cynara'],['Cynara cardunculus'],4,1,6.51827073097229 5619,3150,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.29602873,ISDB,QIVLWPIJESKEMW-JHJDZIRVSA-N,"InChI=1S/C37H60O5/c1-25(17-23-41-27(3)38)12-14-29-26(2)13-15-30-35(29,7)19-11-20-36(30,8)32(39)42-37(9)21-10-18-34(6)22-16-28(24-31(34)37)33(4,5)40/h17,28-31,40H,2,10-16,18-24H2,1,3-9H3/b25-17+/t28-,29+,30-,31-,34-,35-,36+,37-/m1/s1",C=C1CC[C@@H]2[C@](C)(CCC[C@]2(C)C(=O)O[C@]2(C)CCC[C@]3(C)CC[C@@H](C(C)(C)O)C[C@H]32)[C@H]1CC/C(C)=C/COC(C)=O,C37H60O5,,584.4440750199999,QIVLWPIJESKEMW,Terpenoids,Diterpenoids,Labdane diterpenoids,Pinalia japonica,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,0,5.184114933013916 5620,3150,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.29602873,ISDB,QIVLWPIJESKEMW-JHJDZIRVSA-N,"InChI=1S/C37H60O5/c1-25(17-23-41-27(3)38)12-14-29-26(2)13-15-30-35(29,7)19-11-20-36(30,8)32(39)42-37(9)21-10-18-34(6)22-16-28(24-31(34)37)33(4,5)40/h17,28-31,40H,2,10-16,18-24H2,1,3-9H3/b25-17+/t28-,29+,30-,31-,34-,35-,36+,37-/m1/s1",C=C1CC[C@@H]2[C@](C)(CCC[C@]2(C)C(=O)O[C@]2(C)CCC[C@]3(C)CC[C@@H](C(C)(C)O)C[C@H]32)[C@H]1CC/C(C)=C/COC(C)=O,C37H60O5,,584.4440750199999,QIVLWPIJESKEMW,Terpenoids,Diterpenoids,Labdane diterpenoids,Conchidium japonicum,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,0,5.184114933013916 5621,3148,431,Shikimates and Phenylpropanoids,Monoterpenoids,Simple coumarins,0.72241455,ISDB,ICFLIFNKWPXOAM-UHFFFAOYSA-N,"InChI=1S/C10H8O5/c1-14-7-4-6-5(9(12)10(7)13)2-3-8(11)15-6/h2-4,12-13H,1H3",COc1cc2oc(=O)ccc2c(O)c1O,C10H8O5,,208.037173356,ICFLIFNKWPXOAM,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Rhamnus disperma,6109464.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rhamnaceae'],['Rhamneae'],['Rhamnus'],['Rhamnus disperma'],4,3,8.389658212661743 5622,3148,431,Shikimates and Phenylpropanoids,Monoterpenoids,Simple coumarins,0.72241455,ISDB,ICFLIFNKWPXOAM-UHFFFAOYSA-N,"InChI=1S/C10H8O5/c1-14-7-4-6-5(9(12)10(7)13)2-3-8(11)15-6/h2-4,12-13H,1H3",COc1cc2oc(=O)ccc2c(O)c1O,C10H8O5,,208.037173356,ICFLIFNKWPXOAM,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Haplophyllum obtusifolium,762592.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum obtusifolium'],4,3,8.389658212661743 5623,3148,431,Shikimates and Phenylpropanoids,Monoterpenoids,Simple coumarins,0.72241455,ISDB,ICFLIFNKWPXOAM-UHFFFAOYSA-N,"InChI=1S/C10H8O5/c1-14-7-4-6-5(9(12)10(7)13)2-3-8(11)15-6/h2-4,12-13H,1H3",COc1cc2oc(=O)ccc2c(O)c1O,C10H8O5,,208.037173356,ICFLIFNKWPXOAM,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Pelargonium reniforme,56196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Geraniales'],['Geraniaceae'],['Unknown'],['Pelargonium'],['Pelargonium reniforme'],4,3,8.389658212661743 5624,3147,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DXLORNSIGDEVQK-ORHSKWSZSA-N,"InChI=1S/C65H106O30/c1-25-36(68)41(73)46(78)54(86-25)93-51-30(22-67)89-53(50(82)45(51)77)84-23-31-39(71)44(76)49(81)57(90-31)95-59(83)65-18-16-60(3,4)20-28(65)27-10-11-34-62(7)14-13-35(61(5,6)33(62)12-15-64(34,9)63(27,8)17-19-65)92-58-52(94-55-47(79)42(74)37(69)26(2)87-55)40(72)32(24-85-58)91-56-48(80)43(75)38(70)29(21-66)88-56/h10,25-26,28-58,66-82H,11-24H2,1-9H3/t25-,26-,28-,29+,30+,31+,32-,33-,34+,35-,36-,37-,38+,39+,40-,41+,42+,43-,44-,45+,46+,47+,48+,49+,50+,51+,52+,53+,54-,55-,56-,57-,58-,62-,63+,64+,65-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C65H106O30,pos_3_1proton2sodium,1366.6768919919994,DXLORNSIGDEVQK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone davidii,3945174.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone davidii'],7,1,7.5 5625,3147,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DXLORNSIGDEVQK-ORHSKWSZSA-N,"InChI=1S/C65H106O30/c1-25-36(68)41(73)46(78)54(86-25)93-51-30(22-67)89-53(50(82)45(51)77)84-23-31-39(71)44(76)49(81)57(90-31)95-59(83)65-18-16-60(3,4)20-28(65)27-10-11-34-62(7)14-13-35(61(5,6)33(62)12-15-64(34,9)63(27,8)17-19-65)92-58-52(94-55-47(79)42(74)37(69)26(2)87-55)40(72)32(24-85-58)91-56-48(80)43(75)38(70)29(21-66)88-56/h10,25-26,28-58,66-82H,11-24H2,1-9H3/t25-,26-,28-,29+,30+,31+,32-,33-,34+,35-,36-,37-,38+,39+,40-,41+,42+,43-,44-,45+,46+,47+,48+,49+,50+,51+,52+,53+,54-,55-,56-,57-,58-,62-,63+,64+,65-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C65H106O30,pos_3_1proton2sodium,1366.6768919919994,DXLORNSIGDEVQK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,1,7.5 5626,3147,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AGNAAINECZAUIZ-LWZKETDESA-N,"InChI=1S/C65H106O30/c1-25-36(69)41(74)45(78)54(86-25)92-50-31(22-67)89-53(48(81)44(50)77)85-24-32-40(73)43(76)47(80)56(90-32)95-59(83)65-18-16-60(3,4)20-28(65)27-10-11-34-62(7)14-13-35(61(5,6)33(62)12-15-64(34,9)63(27,8)17-19-65)91-58-52(38(71)29(68)23-84-58)94-57-49(82)51(37(70)26(2)87-57)93-55-46(79)42(75)39(72)30(21-66)88-55/h10,25-26,28-58,66-82H,11-24H2,1-9H3/t25-,26-,28-,29+,30+,31+,32+,33-,34+,35-,36-,37-,38-,39+,40+,41+,42-,43-,44+,45+,46+,47+,48+,49+,50+,51+,52+,53+,54-,55-,56-,57-,58-,62-,63+,64+,65-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H]8O)C(C)(C)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C65H106O30,pos_3_1proton2sodium,1366.6768919919991,AGNAAINECZAUIZ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum flaccidum,750046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone flaccida'],7,1,7.5 5627,3146,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-UHFFFAOYSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)",O=C(O)C=Cc1ccc(O)c(O)c1,C9H8O4,pos_1_1proton1methanol,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5628,3146,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton1methanol,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 5629,3144,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_2MNa,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5630,3144,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_2MNa,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 5631,3142,-1,,,,0.33561683,ISDB,YWSIMWUTQXMOSD-FXAINCCUSA-N,"InChI=1S/C12H16O2/c1-8-4-3-5-9-10(13)6-7-11(14)12(8,9)2/h5-8,11,14H,3-4H2,1-2H3/t8-,11-,12+/m1/s1",C[C@@H]1CCC=C2C(=O)C=C[C@@H](O)[C@]21C,C12H16O2,,192.115029752,YWSIMWUTQXMOSD,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,7.342467308044434 5632,3141,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 5633,3141,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 5634,3141,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 5635,3141,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 5636,3141,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 5637,3141,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 5638,3140,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.6616301,ISDB,,,,,,,JRFNLYFCYVJQMF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.6465203762054443 5639,3139,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.5645772,ISDB,BYDQKMZEOZVIJM-ZGCJARKRSA-N,"InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,8-9H,7,10H2,1-4H3/b6-5-,12-9-",C/C=C\C=C1\C(C)=CCCC1(C)C,C13H20,,176.15650064,BYDQKMZEOZVIJM,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Passiflora edulis,183517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora edulis'],4,1,6.7583088874816895 5640,3137,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.6568275,ISDB,KSEBMYQBYZTDHS-UHFFFAOYSA-N,"InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)",COc1cc(C=CC(=O)O)ccc1O,C10H10O4,,194.0579088,KSEBMYQBYZTDHS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,3,10.127310037612915 5641,3137,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.6568275,ISDB,KSEBMYQBYZTDHS-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+",COc1cc(/C=C/C(=O)O)ccc1O,C10H10O4,,194.0579088,KSEBMYQBYZTDHS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,10.127310037612915 5642,3136,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GHPOIRJQBGGCSC-SPFBNEDVSA-N,"InChI=1S/C25H28O12/c1-2-12-13(8-15-17(19(28)23(33)35-15)11-6-4-3-5-7-11)14(22(31)32)10-34-24(12)37-25-21(30)20(29)18(27)16(9-26)36-25/h2-7,10,12-13,15-16,18,20-21,24-30H,1,8-9H2,(H,31,32)/t12-,13+,15-,16-,18-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O)[C@H]1C[C@H]1OC(=O)C(O)=C1c1ccccc1,C25H28O12,pos_1_1proton,520.1580763359998,GHPOIRJQBGGCSC,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5643,3136,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JANONPLUBJJWRY-LDRWPHMTSA-N,"InChI=1S/C25H28O12/c1-2-12-13-8-15(17(19(28)22(31)32)11-6-4-3-5-7-11)35-23(33)14(13)10-34-24(12)37-25-21(30)20(29)18(27)16(9-26)36-25/h2-7,10,12-13,15-16,18,20-21,24-30H,1,8-9H2,(H,31,32)/b19-17+/t12-,13+,15-,16-,18-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@@H](/C(=C(/O)C(=O)O)c3ccccc3)C[C@H]21,C25H28O12,pos_1_1proton,520.1580763359999,JANONPLUBJJWRY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5644,3135,-1,,,,0.73482084,ISDB,WPEARBZAFBYHRG-XVNBXDOJSA-N,"InChI=1S/C25H26O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-3,5-7,9-10,19-20,23,26-30,35H,4,8,11-12H2,(H,33,34)/b7-3+",O=C(/C=C/c1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)CCc1ccc(O)c(O)c1,C25H26O12,,518.142426272,WPEARBZAFBYHRG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salicornia maritima,1024331.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia maritima'],4,0,6.93928337097168 5645,3135,-1,,,,0.73482084,ISDB,WPEARBZAFBYHRG-XVNBXDOJSA-N,"InChI=1S/C25H26O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-3,5-7,9-10,19-20,23,26-30,35H,4,8,11-12H2,(H,33,34)/b7-3+",O=C(/C=C/c1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)CCc1ccc(O)c(O)c1,C25H26O12,,518.142426272,WPEARBZAFBYHRG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salicornia herbacea,321009.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia herbacea'],4,0,6.93928337097168 5646,3135,-1,,,,0.73482084,ISDB,WPEARBZAFBYHRG-XVNBXDOJSA-N,"InChI=1S/C25H26O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-3,5-7,9-10,19-20,23,26-30,35H,4,8,11-12H2,(H,33,34)/b7-3+",O=C(/C=C/c1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)CCc1ccc(O)c(O)c1,C25H26O12,,518.142426272,WPEARBZAFBYHRG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salicornia fruticosa,163178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia fruticosa'],4,0,6.93928337097168 5647,3135,-1,,,,0.73482084,ISDB,WPEARBZAFBYHRG-XVNBXDOJSA-N,"InChI=1S/C25H26O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-3,5-7,9-10,19-20,23,26-30,35H,4,8,11-12H2,(H,33,34)/b7-3+",O=C(/C=C/c1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)CCc1ccc(O)c(O)c1,C25H26O12,,518.142426272,WPEARBZAFBYHRG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Sarcocornia fruticosa,163178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia fruticosa'],4,0,6.93928337097168 5648,3135,-1,,,,0.73482084,ISDB,WPEARBZAFBYHRG-XVNBXDOJSA-N,"InChI=1S/C25H26O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-3,5-7,9-10,19-20,23,26-30,35H,4,8,11-12H2,(H,33,34)/b7-3+",O=C(/C=C/c1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)CCc1ccc(O)c(O)c1,C25H26O12,,518.142426272,WPEARBZAFBYHRG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Arthrocnemum fruticosum,163178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia fruticosa'],4,0,6.93928337097168 5649,3133,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_sodium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 5650,3133,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_sodium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 5651,3133,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_sodium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 5652,3133,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_sodium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 5653,3132,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6480916,ISDB,PTWPWUVEQZXOFJ-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-6-3-1-2-5-4-11-8(10)7(5)6/h1-3,9H,4H2",O=C1OCc2cccc(O)c21,C8H6O3,,150.031694052,PTWPWUVEQZXOFJ,Polyketides,Cyclic polyketides,Phthalide derivatives,Cladosporium,984626.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Capnodiales'],['Cladosporiaceae'],['Unknown'],['Cladosporium'],['Unknown'],1,3,5.092366456985474 5654,3132,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.6480916,ISDB,PTWPWUVEQZXOFJ-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-6-3-1-2-5-4-11-8(10)7(5)6/h1-3,9H,4H2",O=C1OCc2cccc(O)c21,C8H6O3,,150.031694052,PTWPWUVEQZXOFJ,Polyketides,Cyclic polyketides,Phthalide derivatives,Calvolia,186102.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Arachnida'],['Sarcoptiformes'],['Winterschmidtiidae'],['Unknown'],['Calvolia'],['Unknown'],1,3,5.092366456985474 5655,3131,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.60563844,ISDB,RJLAJQDKXWWUNG-UHFFFAOYSA-N,"InChI=1S/C13H18O/c1-8-4-5-9(2)12-11(8)7-6-10(3)13(12)14/h4-5,10,13-14H,6-7H2,1-3H3",Cc1ccc(C)c2c1CCC(C)C2O,C13H18O,,190.135765196,RJLAJQDKXWWUNG,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,2,7.422553777694702 5656,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Skimmia reevesiana,186532.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Skimmia'],['Skimmia reevesiana'],4,1,8.280557870864868 5657,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia ordosica,441241.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia ordosica'],4,1,8.280557870864868 5658,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-UHFFFAOYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2",O=c1ccc2ccc(OC3OC(CO)C(O)C(O)C3O)cc2o1,C15H16O8,,324.0845174719999,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Edgeworthia chrysantha,268293.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Edgeworthia'],['Edgeworthia chrysantha'],4,1,8.280557870864868 5659,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Eucalyptus viminalis,566581.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Myrtaceae'],['Eucalypteae'],['Eucalyptus'],['Eucalyptus viminalis'],4,1,8.280557870864868 5660,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Skimmia japonica,790015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Skimmia'],['Skimmia japonica'],4,1,8.280557870864868 5661,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Angelica dahurica,49588.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Angelica'],['Angelica dahurica'],4,1,8.280557870864868 5662,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Hydrangea macrophylla,162001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea macrophylla'],4,1,8.280557870864868 5663,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Saussurea superba,561049.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea superba'],4,1,8.280557870864868 5664,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Saussurea hieracioides,40090.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea hieracioides'],4,1,8.280557870864868 5665,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-BGNCJLHMSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12+,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,1,8.280557870864868 5666,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-BGNCJLHMSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12+,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,1,8.280557870864868 5667,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Adina cordifolia,315681.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Haldina'],['Haldina cordifolia'],4,1,8.280557870864868 5668,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-BGNCJLHMSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12+,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Stellera chamaejasme,191882.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Stellera'],['Stellera chamaejasme'],4,1,8.280557870864868 5669,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-UHFFFAOYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2",O=c1ccc2ccc(OC3OC(CO)C(O)C(O)C3O)cc2o1,C15H16O8,,324.0845174719999,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Daphne feddei,5747011.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Daphne'],['Daphne feddei'],4,1,8.280557870864868 5670,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Aesculus hippocastanum,404238.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Sapindaceae'],['Hippocastaneae'],['Aesculus'],['Aesculus hippocastanum'],4,1,8.280557870864868 5671,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ipomoea nil,77355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Convolvulaceae'],['Ipomoeeae'],['Ipomoea'],['Ipomoea nil'],4,1,8.280557870864868 5672,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-LFHLZQBKSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15+/m1/s1",O=c1ccc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia gmelinii,115033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia gmelinii'],4,1,8.280557870864868 5673,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-BGNCJLHMSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12+,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Phellodendron amurense,1016461.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Phellodendron'],['Phellodendron amurense'],4,1,8.280557870864868 5674,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-LFHLZQBKSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15+/m1/s1",O=c1ccc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia chamaemelifolia,119282.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia chamaemelifolia'],4,1,8.280557870864868 5675,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Rhodiola heterodonta,762829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Crassulaceae'],['Unknown'],['Rhodiola'],['Rhodiola heterodonta'],4,1,8.280557870864868 5676,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Tetradium glabrifolium,164592.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Tetradium'],['Tetradium glabrifolium'],4,1,8.280557870864868 5677,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-UHFFFAOYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2",O=c1ccc2ccc(OC3OC(CO)C(O)C(O)C3O)cc2o1,C15H16O8,,324.0845174719999,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Phellodendron,1016455.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Phellodendron'],['Unknown'],4,1,8.280557870864868 5678,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Astragalus brachycarpus,3923915.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Astragalus'],['Astragalus brachycarpus'],4,1,8.280557870864868 5679,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-TVKJYDDYSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15-/m1/s1",O=c1ccc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Glehnia littoralis,622365.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Glehnia'],['Glehnia littoralis'],4,1,8.280557870864868 5680,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-LFHLZQBKSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15+/m1/s1",O=c1ccc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia stechmanniana,154486.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia santolinifolia'],4,1,8.280557870864868 5681,3130,1429,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.94513947,ISDB,VPAOSFFTKWUGAD-LFHLZQBKSA-N,"InChI=1S/C15H16O8/c16-6-10-12(18)13(19)14(20)15(23-10)21-8-3-1-7-2-4-11(17)22-9(7)5-8/h1-5,10,12-16,18-20H,6H2/t10-,12-,13+,14-,15+/m1/s1",O=c1ccc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C15H16O8,,324.084517472,VPAOSFFTKWUGAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia santolinifolia,154486.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia santolinifolia'],4,1,8.280557870864868 5682,3129,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_2MNa,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 5683,3129,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_2MNa,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 5684,3128,-1,,,,0.6460875,ISDB,SVFYZPAHVKQWTL-UHFFFAOYSA-N,"InChI=1S/C14H12O6/c1-6-3-10-7(5-19-6)12(17)11-8(15)4-9(16)13(18-2)14(11)20-10/h3-4,15-16H,5H2,1-2H3",COc1c(O)cc(O)c2c(=O)c3c(oc12)C=C(C)OC3,C14H12O6,,276.063388104,SVFYZPAHVKQWTL,Polyketides,Chromanes,,Penicillium parvum,361813.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium parvum'],1,0,3.584350109100342 5685,3126,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_1proton1ammonium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,9.0 5686,3126,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_1proton1ammonium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,9.0 5687,3125,431,Shikimates and Phenylpropanoids,Monoterpenoids,Simple coumarins,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1acetonitrile,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,2,9.0 5688,3125,431,Shikimates and Phenylpropanoids,Monoterpenoids,Simple coumarins,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1acetonitrile,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,2,9.0 5689,3124,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,OEGZSLZSZBSXQC-PBSSREKVSA-N,"InChI=1S/C16H22O8/c1-7(2)12(18)23-14-11-15(19)5-10(22-9(4)17)16(11,20)6-21-13(24-14)8(15)3/h7,10-11,13-14,19-20H,3,5-6H2,1-2,4H3/t10-,11-,13+,14+,15-,16-/m0/s1",C=C1[C@@H]2OC[C@]3(O)[C@@H](OC(C)=O)C[C@@]1(O)[C@@H]3[C@H](OC(=O)C(C)C)O2,C16H22O8,pos_1_1proton,342.131467664,OEGZSLZSZBSXQC,Terpenoids,Monoterpenoids,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 5690,3123,174,Terpenoids,Apocarotenoids,Megastigmanes,0.63942766,ISDB,VMGKCCIFXCUSHN-UHFFFAOYSA-N,"InChI=1S/C13H24O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h9,12,14-15H,5-8H2,1-4H3",CC1=C(CCC(C)O)C(C)(C)CCC1O,C13H24O2,,212.177630008,VMGKCCIFXCUSHN,Terpenoids,Apocarotenoids,Megastigmanes,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.057710647583008 5691,3121,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.55603015,ISDB,BVKKHPBKRVEHGR-UHFFFAOYSA-N,"InChI=1S/C10H10O3/c11-5-6-4-9(12)10(13)8-3-1-2-7(6)8/h4-5,12-13H,1-3H2",O=Cc1cc(O)c(O)c2c1CCC2,C10H10O3,,178.06299418,BVKKHPBKRVEHGR,Terpenoids,,,Amomum tsao-ko,698763.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Lanxangia'],['Lanxangia tsaoko'],4,1,6.724120616912842 5692,3121,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.55603015,ISDB,BVKKHPBKRVEHGR-UHFFFAOYSA-N,"InChI=1S/C10H10O3/c11-5-6-4-9(12)10(13)8-3-1-2-7(6)8/h4-5,12-13H,1-3H2",O=Cc1cc(O)c(O)c2c1CCC2,C10H10O3,,178.06299418,BVKKHPBKRVEHGR,Terpenoids,,,Lanxangia tsao-ko,698763.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Lanxangia'],['Lanxangia tsaoko'],4,1,6.724120616912842 5693,3119,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,2,9.0 5694,3119,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,2,9.0 5695,3118,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.62614024,ISDB,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,12.004560947418213 5696,3117,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RODXRVNMMDRFIK-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3",COc1cc2ccc(=O)oc2cc1O,C10H8O4,pos_1_1proton1methanol,192.042258736,RODXRVNMMDRFIK,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Lonicera hypoleuca,5746397.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoleuca'],7,0,7.0 5697,3115,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,PBLWZMSRSJTRHJ-NCIRKIHRSA-N,"InChI=1S/C32H44O16/c1-42-20-8-14(3-5-18(20)45-31-28(40)26(38)24(36)22(11-34)47-31)7-16-13-44-30(17(16)10-33)15-4-6-19(21(9-15)43-2)46-32-29(41)27(39)25(37)23(12-35)48-32/h3-6,8-9,16-17,22-41H,7,10-13H2,1-2H3/t16-,17-,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H44O16,pos_2_2proton2acetonitrile,684.262935328,PBLWZMSRSJTRHJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,1,8.5 5698,3114,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7764435,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya paniculata,81668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya paniculata'],4,3,8.60577392578125 5699,3114,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7764435,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya exotica,755734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya exotica'],4,3,8.60577392578125 5700,3112,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.61927927,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea jamaicensis,431707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea jamaicensis'],4,3,7.97711706161499 5701,3112,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.61927927,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea prunifolia,7606947.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea prunifolia'],4,3,7.97711706161499 5702,3110,-1,,,,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_1proton1ammonium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5703,3110,-1,,,,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_1proton1ammonium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 5704,3108,-1,,,,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1potassium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],8,0,8.0 5705,3108,-1,,,,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1potassium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],8,0,8.0 5706,3107,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,FILRFEXGRQEKMM-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)14(7)23-5-8(6)18)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,FILRFEXGRQEKMM,Terpenoids,Monoterpenoids,,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,2,7.0 5707,3107,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,DPBCFTHDJGXWRI-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(19)16(2,14(7)23-5-8(6)18)25-15-13(22)12(21)11(20)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,DPBCFTHDJGXWRI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,2,7.0 5708,3107,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,DBLVGADGVDUSHJ-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,2,7.0 5709,3107,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,DBLVGADGVDUSHJ-RLIMOHGTSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7+,8-,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,2,7.0 5710,3107,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,RAKWYUWXLTYDQR-LTPIHACHSA-N,"InChI=1S/C16H26O9/c1-6-7-2-10(8(3-17)9(7)5-23-15(6)22)24-16-14(21)13(20)12(19)11(4-18)25-16/h6-14,16-21H,2-5H2,1H3/t6-,7-,8-,9+,10+,11-,12-,13+,14-,16-/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]21,C16H26O9,pos_1_1proton1acetonitrile,362.157682412,RAKWYUWXLTYDQR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,2,7.0 5711,3107,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1acetonitrile,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,2,7.0 5712,3107,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1acetonitrile,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,2,7.0 5713,3106,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.2972201,ISDB,DLHGNEVRISSXIV-UHFFFAOYSA-N,"InChI=1S/C10H8O3/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5,11H,1H3",Cc1cc(=O)c2cccc(O)c2o1,C10H8O3,,176.047344116,DLHGNEVRISSXIV,Polyketides,Chromanes,Chromones,Halenia elliptica,862722.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Gentianaceae'],['Gentianeae'],['Halenia'],['Halenia elliptica'],4,0,5.188880443572998 5714,3105,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ATFJUGCMEQBNLH-UHFFFAOYSA-N,"InChI=1S/C10H14O5/c1-10-6(12)2-4-5(3-11)9(15-10)14-8(13)7(4)10/h4-7,9,11-12H,2-3H2,1H3",CC12OC3OC(=O)C1C(CC2O)C3CO,C10H14O5,pos_1_1proton,214.084123548,ATFJUGCMEQBNLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 5715,3099,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.22556758,ISDB,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.902270317077637 5716,3099,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.22556758,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,2,8.902270317077637 5717,3099,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.22556758,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,2,8.902270317077637 5718,3099,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.22556758,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,2,8.902270317077637 5719,3099,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.22556758,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.902270317077637 5720,3097,1197,,,,0.2625129,ISDB,,,,,,,KNQZTGPSZFBIBI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0500515699386597 5721,3094,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.60123706,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea prunifolia,7606947.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea prunifolia'],4,3,7.9049482345581055 5722,3094,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.60123706,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea jamaicensis,431707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea jamaicensis'],4,3,7.9049482345581055 5723,3092,-1,,,,0.0,MS1_match,BKATZVAUANSCKN-QWRGUYRKSA-N,"InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1",CC(=O)OCC1=CC[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_2MH,194.130679816,BKATZVAUANSCKN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5724,3092,-1,,,,0.0,MS1_match,GVZSSHYAFJPRJY-GARJFASQSA-N,"InChI=1S/C12H18O2/c1-7-10-5-9(12(7,3)4)6-11(10)14-8(2)13/h9-11H,1,5-6H2,2-4H3/t9-,10-,11+/m0/s1",C=C1[C@@H]2C[C@@H](C[C@H]2OC(C)=O)C1(C)C,C12H18O2,pos_2MH,194.130679816,GVZSSHYAFJPRJY,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5725,3092,-1,,,,0.0,MS1_match,RWENJYLCELUBAE-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-8(2)10-6-11(13-4)9(3)12(7-10)14-5/h6-8H,1-5H3",COc1cc(C(C)C)cc(OC)c1C,C12H18O2,pos_2MH,194.130679816,RWENJYLCELUBAE,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5726,3092,-1,,,,0.0,MS1_match,OZBFUQLOVFXDNK-VWYCJHECSA-N,"InChI=1S/C12H18O2/c1-7-5-11(14-8(2)13)10-6-9(7)12(10,3)4/h5,9-11H,6H2,1-4H3/t9-,10+,11+/m1/s1",CC(=O)O[C@H]1C=C(C)[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_2MH,194.130679816,OZBFUQLOVFXDNK,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5727,3092,-1,,,,0.0,MS1_match,PBWRFXQNNGSAQG-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3",C=C1C(OC(C)=O)CC2(C(C)C)CC12,C12H18O2,pos_2MH,194.130679816,PBWRFXQNNGSAQG,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5728,3092,-1,,,,0.0,MS1_match,ALVJDUNBMKMTDC-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-12(2,3)10-8-9(13-4)6-7-11(10)14-5/h6-8H,1-5H3",COc1ccc(OC)c(C(C)(C)C)c1,C12H18O2,pos_2MH,194.130679816,ALVJDUNBMKMTDC,Shikimates and Phenylpropanoids,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5729,3089,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.5890906,ISDB,OMHJQGZJZUFMMT-AJHRVBBASA-N,"InChI=1S/C27H34O3/c28-19-11-8-17(9-12-19)6-4-2-1-3-5-7-20-21-14-15-22-23(27(29)30)13-10-18-16-24(20)26(21)25(18)22/h8-15,18,20-26,28H,1-7,16H2,(H,29,30)/t18-,20-,21-,22+,23-,24+,25-,26-/m1/s1",O=C(O)[C@@H]1C=C[C@@H]2C[C@H]3[C@H](CCCCCCCc4ccc(O)cc4)[C@H]4C=C[C@@H]1[C@@H]2[C@H]43,C27H34O3,,406.250794948,OMHJQGZJZUFMMT,,,,Beilschmiedia ferruginea,6025446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Beilschmiedia'],['Beilschmiedia ferruginea'],0,0,2.3563623428344727 5730,3086,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.44615874,ISDB,QPRMGHKASRLPJP-FGTMMUONSA-N,"InChI=1S/C18H35NO2/c1-15(20)11-9-7-5-3-4-6-8-10-12-17-13-14-18(21)16(2)19-17/h16-19,21H,3-14H2,1-2H3/t16-,17+,18-/m1/s1",CC(=O)CCCCCCCCCC[C@H]1CC[C@@H](O)[C@@H](C)N1,C18H35NO2,,297.26677936,QPRMGHKASRLPJP,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Elaeodendron matabelicum,629055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Elaeodendron'],['Elaeodendron matabelicum'],6,0,7.784634947776794 5731,3084,1832,Alkaloids,Pseudoalkaloids,Fatty acyl glycosides of mono- and disaccharides,0.26971313,ISDB,JOQZJJZBJBXADU-CAMKMCDZSA-N,"InChI=1S/C26H50O8/c1-2-3-4-5-6-7-8-9-10-13-16-20(17-14-11-12-15-18-22(28)29)33-26-25(32)24(31)23(30)21(19-27)34-26/h20-21,23-27,30-32H,2-19H2,1H3,(H,28,29)/t20-,21+,23+,24-,25+,26+/m0/s1",CCCCCCCCCCCC[C@@H](CCCCCCC(=O)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C26H50O8,,490.35056856,JOQZJJZBJBXADU,Fatty acids,Fatty acyl glycosides,Fatty acyl glycosides of mono- and disaccharides,Proboscidea louisianica,541942.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Martyniaceae'],['Unknown'],['Proboscidea'],['Proboscidea louisiana'],4,3,6.578852534294128 5732,3084,1832,Alkaloids,Pseudoalkaloids,Fatty acyl glycosides of mono- and disaccharides,0.26971313,ISDB,JOQZJJZBJBXADU-CAMKMCDZSA-N,"InChI=1S/C26H50O8/c1-2-3-4-5-6-7-8-9-10-13-16-20(17-14-11-12-15-18-22(28)29)33-26-25(32)24(31)23(30)21(19-27)34-26/h20-21,23-27,30-32H,2-19H2,1H3,(H,28,29)/t20-,21+,23+,24-,25+,26+/m0/s1",CCCCCCCCCCCC[C@@H](CCCCCCC(=O)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C26H50O8,,490.35056856,JOQZJJZBJBXADU,Fatty acids,Fatty acyl glycosides,Fatty acyl glycosides of mono- and disaccharides,Proboscidea louisiana,541942.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Martyniaceae'],['Unknown'],['Proboscidea'],['Proboscidea louisiana'],4,3,6.578852534294128 5733,3082,693,Terpenoids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,OIMXTYUHMBQQJM-HSVWHVBGSA-N,"InChI=1S/C28H40O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,17-20,24,26H,11-16H2,1-6H3/b8-7+/t19-,20+,24+,26-,27-,28+/m0/s1",CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CCC2=C3C=CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C,C28H40O,pos_2MCH3CNNa,392.3079159,OIMXTYUHMBQQJM,Terpenoids,Steroids,Ergostane steroids,Gymnosporia acuminata,906995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus hookeri'],6,1,6.5 5734,3081,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.7311604,ISDB,OEJYWQCXHNOOHC-ZXEGGCGDSA-N,"InChI=1S/C24H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)32-23(21-26)22-31-33(28,29)30-20-19-25(2,3)4/h10-11,23,26H,5-9,12-22H2,1-4H3/b11-10-/t23-/m1/s1",CCCCCC/C=C\CCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])OCC[N+](C)(C)C,C24H48NO7P,,493.316839506,OEJYWQCXHNOOHC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Drosophila melanogaster,505714.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Diptera'],['Drosophilidae'],['Drosophilini'],['Drosophila'],['Drosophila melanogaster'],1,3,5.4246416091918945 5735,3081,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.7311604,ISDB,OEJYWQCXHNOOHC-ZXEGGCGDSA-N,"InChI=1S/C24H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)32-23(21-26)22-31-33(28,29)30-20-19-25(2,3)4/h10-11,23,26H,5-9,12-22H2,1-4H3/b11-10-/t23-/m1/s1",CCCCCC/C=C\CCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])OCC[N+](C)(C)C,C24H48NO7P,,493.316839506,OEJYWQCXHNOOHC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Saccharomyces cerevisiae,356221.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Unknown'],['Saccharomycetales'],['Saccharomycetaceae'],['Unknown'],['Saccharomyces'],['Saccharomyces cerevisiae'],1,3,5.4246416091918945 5736,3080,1097,Fatty acids,Diterpenoids,Fatty ethers,0.6641893,ISDB,ZHADMZSKNJUERU-BWLZIVRNSA-N,"InChI=1S/C19H30O3/c1-3-4-5-6-8-11-14-17-22-18-15-12-9-7-10-13-16-19(20)21-2/h4-5,8,11,14-15,17-18H,3,6-7,9-10,12-13,16H2,1-2H3/b5-4-,11-8-,17-14+,18-15+",CC/C=C\C/C=C\C=C\O/C=C/CCCCCCC(=O)OC,C19H30O3,,306.21949482,ZHADMZSKNJUERU,Fatty acids,Fatty acyls,Fatty ethers,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,8.156757116317749 5737,3079,-1,,,,0.0,MS1_match,XFMPEFQVKDOPPT-UYJXDEQJSA-N,"InChI=1S/C25H34O12/c1-34-17-10-14(5-6-15(17)29)21(30)19(11-27)35-16-7-4-13(3-2-8-26)9-18(16)36-25-24(33)23(32)22(31)20(12-28)37-25/h4-7,9-10,19-33H,2-3,8,11-12H2,1H3/t19-,20-,21-,22-,23+,24-,25-/m1/s1",COc1cc([C@@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C25H34O12,pos_2_2proton2acetonitrile,526.205026528,XFMPEFQVKDOPPT,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 5738,3078,-1,,,,0.0,MS1_match,BVEVSYQMQABMQM-UHFFFAOYSA-N,"InChI=1S/C21H36O11/c1-19(2)9-4-12(20(19,3)5-10(9)23)32-17-15(26)14(25)13(24)11(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-18,22-28H,4-8H2,1-3H3",CC1(C)C2CC(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C1(C)CC2O,C21H36O11,pos_1_sodium,464.225761972,BVEVSYQMQABMQM,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5739,3076,-1,,,,0.0,MS1_match,XWOHZIIPBYAMJX-KHBMLBSESA-N,"InChI=1S/C11H16O5/c1-5-8(12)3-6-7(10(13)15-2)4-16-11(14)9(5)6/h4-6,8-9,11-12,14H,3H2,1-2H3/t5-,6+,8-,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C11H16O5,pos_2MHCH3CN,228.099773612,XWOHZIIPBYAMJX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 5740,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,0,6.0 5741,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana condamoana,6061611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana condamoana'],6,0,6.0 5742,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 5743,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,0,6.0 5744,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,0,6.0 5745,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,0,6.0 5746,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,0,6.0 5747,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5748,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,0,6.0 5749,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,0,6.0 5750,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,0,6.0 5751,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5752,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 5753,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,0,6.0 5754,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,0,6.0 5755,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,0,6.0 5756,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,0,6.0 5757,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,0,6.0 5758,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,0,6.0 5759,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,0,6.0 5760,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,0,6.0 5761,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,0,6.0 5762,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,0,6.0 5763,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,0,6.0 5764,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,0,6.0 5765,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,0,6.0 5766,3076,-1,,,,0.0,MS1_match,HJTVDWWIPXDJBB-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-6(5-12)7-4-8(13)11(2,15)9(7)10(14)16-3/h5,7-9,13,15H,1,4H2,2-3H3",C=C(C=O)C1CC(O)C(C)(O)C1C(=O)OC,C11H16O5,pos_2MHCH3CN,228.099773612,HJTVDWWIPXDJBB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5767,3076,-1,,,,0.0,MS1_match,NGJFTIGDSFYTPY-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-11-7(12)3-5-6(4-15-11)10(14-2)16-9(13)8(5)11/h5-8,10,12H,3-4H2,1-2H3",COC1OC(=O)C2C3CC(O)C2(C)OCC13,C11H16O5,pos_2MHCH3CN,228.099773612,NGJFTIGDSFYTPY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5768,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,0,6.0 5769,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,0,6.0 5770,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana condamoana,6061611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana condamoana'],6,0,6.0 5771,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 5772,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,0,6.0 5773,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,0,6.0 5774,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,0,6.0 5775,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,0,6.0 5776,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5777,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,0,6.0 5778,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,0,6.0 5779,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5780,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,0,6.0 5781,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-IRNZINHNSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18?,21-,22?,24-/m1/s1",CC(=O)OCC1=COC(OC(=O)CC(C)C)[C@H]2C1=CC(OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.199547224,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 5782,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,0,6.0 5783,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,0,6.0 5784,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,0,6.0 5785,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,0,6.0 5786,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,0,6.0 5787,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,0,6.0 5788,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,0,6.0 5789,3076,-1,,,,0.0,MS1_match,FWKBQAVMKVZEOT-STCFVSJZSA-N,"InChI=1S/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H32O10,pos_1_1proton1ammonium,480.1995472239999,FWKBQAVMKVZEOT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,0,6.0 5790,3076,-1,,,,0.0,MS1_match,VSUJAXGURPSNJL-UHFFFAOYSA-N,"InChI=1S/C24H32O10/c1-12(2)7-19(27)33-18-8-17-16(9-29-14(5)25)10-30-23(20(17)24(18)11-31-24)34-22(28)21(13(3)4)32-15(6)26/h8,10,12-13,18,20-21,23H,7,9,11H2,1-6H3",CC(=O)OCC1=COC(OC(=O)C(OC(C)=O)C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C24H32O10,pos_1_1proton1ammonium,480.199547224,VSUJAXGURPSNJL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5791,3070,147,Terpenoids,Monoterpenoids,Aristolane sesquiterpenoids,0.0,MS1_match,ZJIVEFDADFTLMI-ULWTYWRYSA-N,"InChI=1S/C15H24O2/c1-8-5-9(16)6-10-12(17)7-11-13(14(11,2)3)15(8,10)4/h6,8-9,11-13,16-17H,5,7H2,1-4H3/t8-,9-,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2[C@@H](O)C[C@@H]3[C@@H](C3(C)C)[C@]21C,C15H24O2,pos_1_1proton1methanol,236.177630008,ZJIVEFDADFTLMI,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 5792,3069,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.23206627,ISDB,CDKNUBLSEZJSAU-YIXWCVDNSA-N,"InChI=1S/C20H30O5/c1-17(15(21)22)7-3-8-20(16(23)24)13(17)6-9-19-10-12(4-5-14(19)20)18(2,25)11-19/h12-14,25H,3-11H2,1-2H3,(H,21,22)(H,23,24)/t12-,13-,14-,17-,18-,19+,20+/m1/s1",C[C@@]1(C(=O)O)CCC[C@@]2(C(=O)O)[C@@H]3CC[C@@H]4C[C@@]3(CC[C@@H]21)C[C@@]4(C)O,C20H30O5,,350.20932406,CDKNUBLSEZJSAU,Terpenoids,Diterpenoids,Gibberellins,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,1,7.42826509475708 5793,3068,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,pos_1_1proton1acetonitrile,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,3,7.5 5794,3063,545,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HCGUNEDCTVLVNP-HVLDEAOBSA-N,"InChI=1S/C27H38O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h10-11,13,15-16,21,25-26,32H,8-9,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H38O10,pos_2_2proton2acetonitrile,522.2464974159999,HCGUNEDCTVLVNP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 5795,3061,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.3616679,ISDB,NHVGKAGJOWJYCD-XDIPGYKVSA-N,"InChI=1S/C39H73NO9/c1-3-5-7-9-11-13-15-16-18-19-21-23-25-27-32(42)31(30-48-39-37(46)36(45)35(44)34(29-41)49-39)40-38(47)33(43)28-26-24-22-20-17-14-12-10-8-6-4-2/h18-19,25,27,31-37,39,41-46H,3-17,20-24,26,28-30H2,1-2H3,(H,40,47)/b19-18+,27-25+/t31-,32+,33+,34+,35+,36-,37+,39+/m0/s1",CCCCCCCCC/C=C/CC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCC,C39H73NO9,,699.5285329159999,NHVGKAGJOWJYCD,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Allium sativum,748370.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium sativum'],4,3,6.9466716051101685 5796,3060,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 5797,3060,-1,,,,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_sodium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 5798,3058,-1,,,,0.0,MS1_match,IMNHFZIFCBHSQR-RWKYFSGOSA-N,"InChI=1S/C48H74O20/c1-22-41(66-36-16-31(52)42(23(2)62-36)67-37-17-32(59-5)43(24(3)63-37)68-44-40(56)39(55)38(54)33(19-49)65-44)30(51)15-35(61-22)64-26-6-11-46(21-50)28-7-10-45(4)27(25-14-34(53)60-20-25)9-13-48(45,58)29(28)8-12-47(46,57)18-26/h14,21-24,26-33,35-44,49,51-52,54-58H,6-13,15-20H2,1-5H3/t22-,23-,24-,26+,27-,28+,29-,30+,31+,32-,33-,35+,36+,37+,38-,39+,40-,41-,42-,43+,44+,45-,46+,47+,48+/m1/s1",CO[C@@H]1C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@]5(C=O)[C@H]6CC[C@]7(C)[C@@H](C8=CC(=O)OC8)CC[C@]7(O)[C@@H]6CC[C@]5(O)C4)O[C@@H]3C)O[C@@H]2C)O[C@H](C)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C48H74O20,pos_2_1proton1sodium,970.477344768,IMNHFZIFCBHSQR,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 5799,3058,-1,,,,0.0,MS1_match,IMNHFZIFCBHSQR-GTRACWGGSA-N,"InChI=1S/C48H74O20/c1-22-41(66-36-16-31(52)42(23(2)62-36)67-37-17-32(59-5)43(24(3)63-37)68-44-40(56)39(55)38(54)33(19-49)65-44)30(51)15-35(61-22)64-26-6-11-46(21-50)28-7-10-45(4)27(25-14-34(53)60-20-25)9-13-48(45,58)29(28)8-12-47(46,57)18-26/h14,21-24,26-33,35-44,49,51-52,54-58H,6-13,15-20H2,1-5H3/t22-,23-,24-,26+,27-,28?,29?,30+,31+,32-,33-,35+,36+,37+,38-,39+,40-,41-,42-,43-,44+,45-,46+,47+,48+/m1/s1",CO[C@@H]1C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@]5(C=O)C6CC[C@]7(C)[C@@H](C8=CC(=O)OC8)CC[C@]7(O)C6CC[C@]5(O)C4)O[C@@H]3C)O[C@@H]2C)O[C@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C48H74O20,pos_2_1proton1sodium,970.477344768,IMNHFZIFCBHSQR,Terpenoids,Steroids,Cardenolides,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,0,6.0 5800,3056,729,Terpenoids,Diterpenoids,Abietane diterpenoids,0.35535866,ISDB,UIJOYOSDYSTACV-UHFFFAOYSA-N,"InChI=1S/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-12,18,21-22H,6-8H2,1-5H3",CC(C)c1cc2c(cc1O)C1(C)CCCC(C)(C)C1C=C2O,C20H28O2,,300.208930136,UIJOYOSDYSTACV,Terpenoids,Diterpenoids,Abietane diterpenoids,Salvia triloba,287408.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia fruticosa'],4,3,6.921434640884399 5801,3056,729,Terpenoids,Diterpenoids,Abietane diterpenoids,0.35535866,ISDB,UIJOYOSDYSTACV-UHFFFAOYSA-N,"InChI=1S/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-12,18,21-22H,6-8H2,1-5H3",CC(C)c1cc2c(cc1O)C1(C)CCCC(C)(C)C1C=C2O,C20H28O2,,300.208930136,UIJOYOSDYSTACV,Terpenoids,Diterpenoids,Abietane diterpenoids,Salvia fruticosa,287408.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia fruticosa'],4,3,6.921434640884399 5802,3054,-1,,,,0.27252612,ISDB,,,,,,,IPZODHUFASKBDV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0901044607162476 5803,3053,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.29908368,ISDB,LOMSXVINRLISDY-VYRBHSGPSA-N,"InChI=1S/C17H28O5/c1-2-3-4-5-6-7-8-9-10-11-12-14(17(21)22)16(20)15(19)13-18/h8-12,15-16,18-20H,2-7,13H2,1H3,(H,21,22)/t15-,16?/m0/s1",CCCCCCCC=CC=CC=C(C(=O)O)C(O)[C@@H](O)CO,C17H28O5,,312.193673996,LOMSXVINRLISDY,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Cytospora populina,5316824.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Diaporthales'],['Valsaceae'],['Unknown'],['Cytospora'],['Cytospora populina'],1,0,2.196334719657898 5804,3050,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.2059535,ISDB,RGAZJYSRPZSBTF-GVVOHZSFSA-N,"InChI=1S/C40H52O2/c1-29(18-13-20-31(3)23-25-35-33(5)22-15-27-39(35,7)8)16-11-12-17-30(2)19-14-21-32(4)24-26-36-34(6)38(42)37(41)28-40(36,9)10/h11-14,16-21,23-26,28,41H,15,22,27H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,29-16+,30-17+,31-20+,32-21+",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)C(O)=CC2(C)C)C(C)(C)CCC1,C40H52O2,,564.396730904,RGAZJYSRPZSBTF,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Adonis annua,804994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis annua'],6,3,8.32381397485733 5805,3049,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.6244017,ISDB,JREXFVZSWAOXFR-UHFFFAOYSA-N,"InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h3H,1,4-12,15-18H2,2H3",C=CCCCCCCCCCC#CCCCCC(=O)OC,C19H32O2,,292.240230264,JREXFVZSWAOXFR,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Alvaradoa amorphoides,210340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Picramniales'],['Picramniaceae'],['Unknown'],['Alvaradoa'],['Alvaradoa amorphoides'],4,3,7.9976067543029785 5806,3047,361,,,,0.39444405,ISDB,,,,,,,NSRUZMAXAKXRDE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5777761936187744 5807,3046,-1,,,,0.49704218,ISDB,OHUWCLPFQBDELY-MVXBXNQRSA-N,"InChI=1S/C26H36O10/c1-25(2)7-4-8-26(3)14(25)6-5-11-17(26)16-15(12(9-27)18(11)29)22(33)35-23(16)36-24-21(32)20(31)19(30)13(10-28)34-24/h13-14,19-21,23-24,27-32H,4-10H2,1-3H3/t13-,14+,19-,20+,21-,23-,24+,26+/m1/s1",CC1(C)CCC[C@]2(C)c3c(c(O)c(CO)c4c3[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC4=O)CC[C@@H]12,C26H36O10,,508.230847352,OHUWCLPFQBDELY,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Betonica officinalis,103745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Betonica'],['Betonica officinalis'],4,0,5.988168716430664 5808,3046,-1,,,,0.49704218,ISDB,OHUWCLPFQBDELY-MVXBXNQRSA-N,"InChI=1S/C26H36O10/c1-25(2)7-4-8-26(3)14(25)6-5-11-17(26)16-15(12(9-27)18(11)29)22(33)35-23(16)36-24-21(32)20(31)19(30)13(10-28)34-24/h13-14,19-21,23-24,27-32H,4-10H2,1-3H3/t13-,14+,19-,20+,21-,23-,24+,26+/m1/s1",CC1(C)CCC[C@]2(C)c3c(c(O)c(CO)c4c3[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC4=O)CC[C@@H]12,C26H36O10,,508.230847352,OHUWCLPFQBDELY,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Stachys officinalis,103745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Betonica'],['Betonica officinalis'],4,0,5.988168716430664 5809,3045,-1,,,,0.22175224,ISDB,GDWGKJJMMBZZDX-DGRVRUJCSA-N,"InChI=1S/C30H48O3/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)22-13-16-30-23(10-11-24(31)26(30,4)5)29(22,19-33-30)18-17-27(21,28)6/h8,13-14,16,20-24,31-32H,9-12,15,17-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24-,27-,28+,29+,30+/m1/s1",C[C@H](C/C=C/C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3C=C[C@]45OC[C@]3(CC[C@]12C)[C@@H]4CC[C@@H](O)C5(C)C,C30H48O3,,456.360345396,GDWGKJJMMBZZDX,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Momordica charantia,955521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Momordiceae'],['Momordica'],['Momordica charantia'],4,0,4.887008965015411 5810,3045,-1,,,,0.22175224,ISDB,GDWGKJJMMBZZDX-UHFFFAOYSA-N,"InChI=1S/C30H48O3/c1-20(9-8-14-25(2,3)32)21-12-15-28(7)22-13-16-30-23(10-11-24(31)26(30,4)5)29(22,19-33-30)18-17-27(21,28)6/h8,13-14,16,20-24,31-32H,9-12,15,17-19H2,1-7H3",CC(CC=CC(C)(C)O)C1CCC2(C)C3C=CC45OCC3(CCC12C)C4CCC(O)C5(C)C,C30H48O3,,456.360345396,GDWGKJJMMBZZDX,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Momordica,489567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Momordiceae'],['Momordica'],['Unknown'],4,0,4.887008965015411 5811,3044,-1,,,,0.0,MS1_match,XWOHZIIPBYAMJX-KHBMLBSESA-N,"InChI=1S/C11H16O5/c1-5-8(12)3-6-7(10(13)15-2)4-16-11(14)9(5)6/h4-6,8-9,11-12,14H,3H2,1-2H3/t5-,6+,8-,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C11H16O5,pos_2MHCH3CN,228.099773612,XWOHZIIPBYAMJX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 5812,3044,-1,,,,0.0,MS1_match,HJTVDWWIPXDJBB-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-6(5-12)7-4-8(13)11(2,15)9(7)10(14)16-3/h5,7-9,13,15H,1,4H2,2-3H3",C=C(C=O)C1CC(O)C(C)(O)C1C(=O)OC,C11H16O5,pos_2MHCH3CN,228.099773612,HJTVDWWIPXDJBB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5813,3044,-1,,,,0.0,MS1_match,NGJFTIGDSFYTPY-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-11-7(12)3-5-6(4-15-11)10(14-2)16-9(13)8(5)11/h5-8,10,12H,3-4H2,1-2H3",COC1OC(=O)C2C3CC(O)C2(C)OCC13,C11H16O5,pos_2MHCH3CN,228.099773612,NGJFTIGDSFYTPY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5814,3043,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.20265853,ISDB,UKUPHONHODZPDA-RPQNWQSJSA-N,"InChI=1S/C21H39NO7/c1-2-3-4-9-12-16(24)13-10-7-5-6-8-11-14-17(25)18(26)19(27)21(22,15-23)20(28)29/h11,14,17-19,23,25-27H,2-10,12-13,15,22H2,1H3,(H,28,29)/b14-11+/t17-,18+,19-,21-/m0/s1",CCCCCCC(=O)CCCCCC/C=C/[C@H](O)[C@@H](O)[C@H](O)[C@@](N)(CO)C(=O)O,C21H39NO7,,417.272652588,UKUPHONHODZPDA,Fatty acids,Sphingolipids,Sphingoid bases,Aspergillus fumigatus,278828.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus fumigatus'],1,0,1.8106341361999512 5815,3043,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.20265853,ISDB,UKUPHONHODZPDA-RPQNWQSJSA-N,"InChI=1S/C21H39NO7/c1-2-3-4-9-12-16(24)13-10-7-5-6-8-11-14-17(25)18(26)19(27)21(22,15-23)20(28)29/h11,14,17-19,23,25-27H,2-10,12-13,15,22H2,1H3,(H,28,29)/b14-11+/t17-,18+,19-,21-/m0/s1",CCCCCCC(=O)CCCCCC/C=C/[C@H](O)[C@@H](O)[C@H](O)[C@@](N)(CO)C(=O)O,C21H39NO7,,417.272652588,UKUPHONHODZPDA,Fatty acids,Sphingolipids,Sphingoid bases,Paecilomyces variotii,203037.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Paecilomyces'],['Paecilomyces variotii'],1,0,1.8106341361999512 5816,3040,48,Terpenoids,Diterpenoids,Oleanane triterpenoids,0.0,MS1_match,USMYUFNGIMZGOD-VVYIQUKOSA-N,"InChI=1S/C32H56O14/c1-29(2)17-6-10-31(4)18(30(17,3)9-8-19(29)44-27-25(40)23(38)21(36)15(12-33)42-27)7-11-32(5,46-31)20(14-35)45-28-26(41)24(39)22(37)16(13-34)43-28/h15-28,33-41H,6-14H2,1-5H3/t15-,16-,17-,18+,19-,20+,21-,22-,23+,24+,25-,26-,27+,28+,30-,31+,32-/m1/s1",CC1(C)[C@H]2CC[C@]3(C)O[C@@](C)([C@H](CO)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@H]3[C@]2(C)CC[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H56O14,pos_1_1proton2acetonitrile,664.367006472,USMYUFNGIMZGOD,Terpenoids,Diterpenoids,,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,2,7.0 5817,3040,48,Terpenoids,Diterpenoids,Oleanane triterpenoids,0.0,MS1_match,UGXGNDFGUYJPTJ-SVVOPOECSA-N,"InChI=1S/C32H56O14/c1-29(2)17-6-10-31(4)18(30(17,3)9-8-20(29)45-28-26(41)24(39)22(37)16(13-34)44-28)7-11-32(5,46-31)19(35)14-42-27-25(40)23(38)21(36)15(12-33)43-27/h15-28,33-41H,6-14H2,1-5H3/t15-,16-,17-,18+,19+,20-,21-,22-,23+,24+,25-,26-,27-,28+,30-,31+,32-/m1/s1",CC1(C)[C@H]2CC[C@]3(C)O[C@@](C)([C@@H](O)CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@H]3[C@]2(C)CC[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H56O14,pos_1_1proton2acetonitrile,664.367006472,UGXGNDFGUYJPTJ,Terpenoids,Diterpenoids,,Microtropis japonica,828316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis japonica'],6,2,7.0 5818,3038,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.65799195,ISDB,OTKJDMGTUTTYMP-ZWKOTPCHSA-N,"InChI=1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17-18,20-21H,2-16,19H2,1H3/t17-,18+/m0/s1",CCCCCCCCCCCCCCC[C@@H](O)[C@@H](N)CO,C18H39NO2,,301.298079488,OTKJDMGTUTTYMP,Fatty acids,Sphingolipids,Sphingoid bases,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,2,7.631967782974243 5819,3037,1060,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.22248583,ISDB,YZEQIXSOBPPRCV-CKMYOLOSSA-N,"InChI=1S/C14H22O10/c15-3-5-8(17)11(20)12(21)14(23-5)24-13-6-4(1-2-22-13)7(16)10(19)9(6)18/h1-2,4-21H,3H2/t4-,5-,6+,7+,8-,9-,10-,11+,12-,13+,14+/m1/s1",OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O,C14H22O10,,350.121296904,YZEQIXSOBPPRCV,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Retzia capensis,637426.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Stilbaceae'],['Unknown'],['Retzia'],['Retzia capensis'],4,3,6.389943301677704 5820,3036,-1,,,,0.4128893,ISDB,BIXCWCVYGIQELL-QURGRASLSA-N,"InChI=1S/C32H58N2O7/c1-6-7-8-9-10-11-12-13-14-15-16-20-27(35)41-26(22-21-24(2)3)28(36)29(37)30(40-5)31(38)33-25-19-17-18-23-34(4)32(25)39/h21-22,24-26,28-30,36-37H,6-20,23H2,1-5H3,(H,33,38)/b22-21+",CCCCCCCCCCCCCC(=O)OC(/C=C/C(C)C)C(O)C(O)C(OC)C(=O)NC1CCCCN(C)C1=O,C32H58N2O7,,582.424402196,BIXCWCVYGIQELL,Amino acids and Peptides,Oligopeptides,Lipopeptides,Rhabdastrella globostellata,583165.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Tetractinellida'],['Ancorinidae'],['Unknown'],['Rhabdastrella'],['Rhabdastrella globostellata'],1,0,2.651557207107544 5821,3035,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.22096595,ISDB,TYAGAGGQBBYQMU-FPQGUNAKSA-N,"InChI=1S/C23H36O5/c1-15(10-13-24)8-9-18-16(2)19(28-17(3)25)14-20-22(18,4)11-7-12-23(20,5)21(26)27-6/h10,18-20,24H,2,7-9,11-14H2,1,3-6H3/b15-10+/t18-,19-,20+,22+,23-/m0/s1",C=C1[C@@H](OC(C)=O)C[C@@H]2[C@](C)(CCC[C@]2(C)C(=O)OC)[C@H]1CC/C(C)=C/CO,C23H36O5,,392.2562742519999,TYAGAGGQBBYQMU,Terpenoids,Diterpenoids,Labdane diterpenoids,Pinalia japonica,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,1,5.383863806724548 5822,3035,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.22096595,ISDB,TYAGAGGQBBYQMU-FPQGUNAKSA-N,"InChI=1S/C23H36O5/c1-15(10-13-24)8-9-18-16(2)19(28-17(3)25)14-20-22(18,4)11-7-12-23(20,5)21(26)27-6/h10,18-20,24H,2,7-9,11-14H2,1,3-6H3/b15-10+/t18-,19-,20+,22+,23-/m0/s1",C=C1[C@@H](OC(C)=O)C[C@@H]2[C@](C)(CCC[C@]2(C)C(=O)OC)[C@H]1CC/C(C)=C/CO,C23H36O5,,392.2562742519999,TYAGAGGQBBYQMU,Terpenoids,Diterpenoids,Labdane diterpenoids,Conchidium japonicum,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,1,5.383863806724548 5823,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,1,7.017025709152222 5824,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Mirabilis himalaica,985176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Nyctaginaceae'],['Unknown'],['Mirabilis'],['Mirabilis himalaica'],4,1,7.017025709152222 5825,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-RISUCRHXSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6+,10-9+/t20-/m1/s1",CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Bauhinia purpurea,560318.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Bauhinia'],['Bauhinia purpurea'],4,1,7.017025709152222 5826,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-IHNKIBRCSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6+,10-9-/t20-/m1/s1",CCCCC/C=C/C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Hyoscyamus niger,822716.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Hyoscyameae'],['Hyoscyamus'],['Hyoscyamus niger'],4,1,7.017025709152222 5827,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-UHFFFAOYSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3",CCCCCC=CCC=CCCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Bauhinia,560314.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Bauhinia'],['Unknown'],4,1,7.017025709152222 5828,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Saururus chinensis,154036.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Saururaceae'],['Unknown'],['Saururus'],['Saururus chinensis'],4,1,7.017025709152222 5829,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-HZJYTTRNSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Nelumbo nucifera,532288.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Proteales'],['Nelumbonaceae'],['Unknown'],['Nelumbo'],['Nelumbo nucifera'],4,1,7.017025709152222 5830,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-HZJYTTRNSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Saposhnikovia divaricata,737496.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Saposhnikovia'],['Saposhnikovia divaricata'],4,1,7.017025709152222 5831,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-RISUCRHXSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6+,10-9+/t20-/m1/s1",CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Bhesa paniculata,1079062.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Centroplacaceae'],['Unknown'],['Bhesa'],['Bhesa paniculata'],4,1,7.017025709152222 5832,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Premna microphylla,503286.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Premna'],['Premna microphylla'],4,1,7.017025709152222 5833,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Adenocaulon himalaicum,935632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Mutisieae'],['Adenocaulon'],['Adenocaulon himalaicum'],4,1,7.017025709152222 5834,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Hernandia ovigera,1072062.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia ovigera'],4,1,7.017025709152222 5835,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Hernandia guianensis,373836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia guianensis'],4,1,7.017025709152222 5836,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Vitex agnus-castus,988127.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Vitex'],['Vitex agnus-castus'],4,1,7.017025709152222 5837,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-HZJYTTRNSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Pseudostellaria heterophylla,698777.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Alsineae'],['Pseudostellaria'],['Pseudostellaria heterophylla'],4,1,7.017025709152222 5838,3034,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6292564,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Polyalthia longifolia,204189.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Monoon'],['Monoon longifolium'],4,1,7.017025709152222 5839,3033,-1,,,,0.35621634,ISDB,XMLSXPIVAXONDL-PLNGDYQASA-N,"InChI=1S/C11H16O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5H,3,6-8H2,1-2H3/b5-4-",CC/C=C\CC1=C(C)CCC1=O,C11H16O,,164.120115132,XMLSXPIVAXONDL,Fatty acids,Octadecanoids,Jasmonic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,8.424865365028381 5840,3032,1459,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,0.0,MS1_match,SYWIUZCNOUKNSM-CMQICLSVSA-N,"InChI=1S/C20H34O/c1-17(2)11-9-14-19(5)13-7-8-15-20(6,21)16-10-12-18(3)4/h8,11-13,15,21H,7,9-10,14,16H2,1-6H3/b15-8?,19-13+",CC(C)=CCC/C(C)=C/CC=CC(C)(O)CCC=C(C)C,C20H34O,pos_1_1proton,290.260965708,SYWIUZCNOUKNSM,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,3,7.5 5841,3025,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HCGUNEDCTVLVNP-HVLDEAOBSA-N,"InChI=1S/C27H38O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h10-11,13,15-16,21,25-26,32H,8-9,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H38O10,pos_1_1proton1methanol,522.2464974159999,HCGUNEDCTVLVNP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 5842,3023,1391,Terpenoids,Diterpenoids,Abietane diterpenoids,0.40865323,ISDB,JVRVYDCPTHHIGR-UHFFFAOYSA-N,"InChI=1S/C19H28O2/c1-11(2)14-10-12-7-8-15-13(6-5-9-19(15,3)4)16(12)18(21)17(14)20/h10-11,13,15,20-21H,5-9H2,1-4H3",CC(C)c1cc2c(c(O)c1O)C1CCCC(C)(C)C1CC2,C19H28O2,,288.208930136,JVRVYDCPTHHIGR,Terpenoids,Diterpenoids,Abietane diterpenoids,Rosmarinus officinalis,778824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia rosmarinus'],4,3,7.1346129179000854 5843,3022,1351,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.3680446,ISDB,FJCQUJKUMKZEMH-UHFFFAOYSA-N,"InChI=1S/C14H22O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h7,10H,5-6,8-9H2,1-4H3",CC(C=O)=CCC1=C(C)CCCC1(C)C,C14H22O,,206.167065324,FJCQUJKUMKZEMH,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.97217845916748 5844,3020,-1,,,,0.2245733,ISDB,AGHYYIRUYLLBAR-DOTOQJQBSA-N,"InChI=1S/C19H32O4/c1-15(20)9-7-5-3-2-4-6-8-10-17(21)11-16-12-18(22)14-19(23)13-16/h12-15,17,20-23H,2-11H2,1H3/t15-,17+/m0/s1",C[C@H](O)CCCCCCCCC[C@@H](O)Cc1cc(O)cc(O)c1,C19H32O4,,324.230059504,AGHYYIRUYLLBAR,Polyketides,,,Ononis pubescens,323322.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis pubescens'],4,0,4.898293197154999 5845,3017,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QPJVMBTYPHYUOC-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3",COC(=O)c1ccccc1,C8H8O2,pos_2MHNH3,136.052429496,QPJVMBTYPHYUOC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 5846,3016,-1,,,,0.66445476,ISDB,AKCAVBOVRWGORC-WOJBJXKFSA-N,"InChI=1S/C20H19NO5/c1-21-5-4-11-6-15-16(25-9-24-15)7-13(11)20(21)8-12-2-3-14-18(26-10-23-14)17(12)19(20)22/h2-3,6-7,19,22H,4-5,8-10H2,1H3/t19-,20-/m1/s1",CN1CCc2cc3c(cc2[C@@]12Cc1ccc4c(c1[C@H]2O)OCO4)OCO3,C20H19NO5,,353.126322708,AKCAVBOVRWGORC,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Fumaria officinalis,76888.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Fumaria'],['Fumaria officinalis'],4,0,6.657819032669067 5847,3014,-1,,,,0.6753685,ISDB,LLNNPDWCMNJBKW-UHFFFAOYSA-N,"InChI=1S/C24H27NO2/c1-13(2)15-9-10-24(4)12-18(15)20-22-17(11-14(3)23(20)27-24)16-7-6-8-19(26-5)21(16)25-22/h6-8,11,15,18,25H,1,9-10,12H2,2-5H3",C=C(C)C1CCC2(C)CC1c1c(c(C)cc3c1[nH]c1c(OC)cccc13)O2,C24H27NO2,,361.204179104,LLNNPDWCMNJBKW,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Murraya euchrestifolia,5233070.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya euchrestifolia'],4,0,6.701473951339722 5848,3010,-1,,,,0.0,MS1_match,HAOOAXFIOQPXIQ-RQAIGCQISA-N,"InChI=1S/C29H44O15/c1-6-13-14(8-20(37-3)38-4)17(11-41-28(13)44-29-24(33)23(32)22(31)19(9-30)43-29)25(34)42-18-7-15-16(12(18)2)10-40-27(36)21(15)26(35)39-5/h6,11-16,18-24,27-33,36H,1,7-10H2,2-5H3/t12-,13+,14+,15-,16+,18+,19-,21+,22+,23+,24-,27+,28+,29+/m1/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3[C@@H](CO[C@H](O)[C@@H]3C(=O)OC)[C@H]2C)[C@H]1CC(OC)OC,C29H44O15,pos_2_2sodium,632.268020708,HAOOAXFIOQPXIQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 5849,3010,-1,,,,0.0,MS1_match,HAOOAXFIOQPXIQ-RQAIGCQISA-N,"InChI=1S/C29H44O15/c1-6-13-14(8-20(37-3)38-4)17(11-41-28(13)44-29-24(33)23(32)22(31)19(9-30)43-29)25(34)42-18-7-15-16(12(18)2)10-40-27(36)21(15)26(35)39-5/h6,11-16,18-24,27-33,36H,1,7-10H2,2-5H3/t12-,13+,14+,15-,16+,18+,19-,21+,22+,23+,24-,27+,28+,29+/m1/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3[C@@H](CO[C@H](O)[C@@H]3C(=O)OC)[C@H]2C)[C@H]1CC(OC)OC,C29H44O15,pos_2_2sodium,632.268020708,HAOOAXFIOQPXIQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 5850,3008,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.5972155,ISDB,JCJMEMDHUZYVMB-OAAMNHTFSA-N,"InChI=1S/C19H34O3/c1-3-4-5-6-8-11-14-17-18(22-17)15-12-9-7-10-13-16-19(20)21-2/h8,11,17-18H,3-7,9-10,12-16H2,1-2H3/b11-8-/t17-,18+/m1/s1",CCCCC/C=C\C[C@H]1O[C@H]1CCCCCCCC(=O)OC,C19H34O3,,310.250794948,JCJMEMDHUZYVMB,Fatty acids,Fatty Acids and Conjugates,Epoxy fatty acids,Aster alpinus,264974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Aster'],['Aster alpinus'],4,2,7.388861894607544 5851,3006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,ATFJUGCMEQBNLH-UHFFFAOYSA-N,"InChI=1S/C10H14O5/c1-10-6(12)2-4-5(3-11)9(15-10)14-8(13)7(4)10/h4-7,9,11-12H,2-3H2,1H3",CC12OC3OC(=O)C1C(CC2O)C3CO,C10H14O5,pos_2MHCH3CN,214.084123548,ATFJUGCMEQBNLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 5852,3003,382,Fatty acids,Fatty esters,Wax monoesters,0.7137505,ISDB,QASFUMOKHFSJGL-LAFRSMQTSA-N,"InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1",CC1=C2C[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C,C27H41NO2,,411.313729552,QASFUMOKHFSJGL,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Veratrum dahuricum,696806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Melanthiaceae'],['Unknown'],['Veratrum'],['Veratrum dahuricum'],4,0,6.855001926422119 5853,3003,382,Fatty acids,Fatty esters,Wax monoesters,0.7137505,ISDB,QASFUMOKHFSJGL-LAFRSMQTSA-N,"InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1",CC1=C2C[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C,C27H41NO2,,411.313729552,QASFUMOKHFSJGL,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Veratrum californicum,603934.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Melanthiaceae'],['Unknown'],['Veratrum'],['Veratrum californicum'],4,0,6.855001926422119 5854,3003,382,Fatty acids,Fatty esters,Wax monoesters,0.7137505,ISDB,QASFUMOKHFSJGL-LAFRSMQTSA-N,"InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1",CC1=C2C[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C,C27H41NO2,,411.313729552,QASFUMOKHFSJGL,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Veratrum grandiflorum,1088325.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Melanthiaceae'],['Unknown'],['Veratrum'],['Veratrum grandiflorum'],4,0,6.855001926422119 5855,3000,-1,,,,0.0,MS1_match,ZZWPMFROUHHAKY-CDVBAKLBSA-O,"InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1/t17-,18-,19-,20-,22-/m1/s1",COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)ccc1O,C22H23O11+,pos_1_1proton2acetonitrile,463.12348797609,ZZWPMFROUHHAKY,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 5856,3000,-1,,,,0.0,MS1_match,ZZWPMFROUHHAKY-CDVBAKLBSA-O,"InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1/t17-,18-,19-,20-,22-/m1/s1",COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)ccc1O,C22H23O11+,pos_1_1proton2acetonitrile,463.12348797609,ZZWPMFROUHHAKY,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 5857,2999,-1,,,,0.29376504,ISDB,DRVBFTZBBRULEX-LHWCIIDMSA-N,"InChI=1S/C30H48O2/c1-18(2)19-9-12-23-28(6)16-13-20-21(29(28,7)17-25(32)30(19,23)8)10-11-22-26(3,4)24(31)14-15-27(20,22)5/h10,13,18-19,22-25,31-32H,9,11-12,14-17H2,1-8H3/t19-,22+,23+,24-,25-,27-,28+,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC[C@@]21C,C30H48O2,,440.365430776,DRVBFTZBBRULEX,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,8.175060153007507 5858,2998,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1proton1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 5859,2998,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1proton1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 5860,2998,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1proton1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 5861,2998,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1proton1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 5862,2998,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1proton1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 5863,2998,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_1_1proton1acetonitrile,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 5864,2989,607,,,,0.20522572,ISDB,IFSGOFCDQVTXIU-RNPORBBMSA-N,"InChI=1S/C34H58O4/c1-5-9-11-13-15-17-19-23-29(7-3)27-37-33(35)31-25-21-22-26-32(31)34(36)38-28-30(8-4)24-20-18-16-14-12-10-6-2/h21-22,25-26,29-30H,5-20,23-24,27-28H2,1-4H3/t29-,30+",CCCCCCCCC[C@@H](CC)COC(=O)c1ccccc1C(=O)OC[C@@H](CC)CCCCCCCCC,C34H58O4,,530.433510336,IFSGOFCDQVTXIU,,,,Nepeta clarkei,6082680.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta clarkei'],4,0,4.8209028840065 5865,2988,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.2561324,ISDB,MWDFPCUZRNPYPD-PDPGQQONSA-N,"InChI=1S/C40H56O5/c1-22(2)24-17-26-28(19-30(24)42)40(10)16-12-14-38(7,8)35(40)34-33(26)44-36(45-34)27-18-25(23(3)4)31(43)20-29(27)39(9)15-11-13-37(5,6)32(39)21-41/h17-23,32-36,42-43H,11-16H2,1-10H3/t32-,33+,34-,35-,36+,39+,40+/m0/s1",CC(C)c1cc([C@H]2O[C@H]3[C@H](O2)c2cc(C(C)C)c(O)cc2[C@@]2(C)CCCC(C)(C)[C@H]32)c([C@@]2(C)CCCC(C)(C)[C@@H]2C=O)cc1O,C40H56O5,,616.412774892,MWDFPCUZRNPYPD,Terpenoids,Diterpenoids,Abietane diterpenoids,Pinalia japonica,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,1,5.524529576301575 5866,2988,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.2561324,ISDB,MWDFPCUZRNPYPD-PDPGQQONSA-N,"InChI=1S/C40H56O5/c1-22(2)24-17-26-28(19-30(24)42)40(10)16-12-14-38(7,8)35(40)34-33(26)44-36(45-34)27-18-25(23(3)4)31(43)20-29(27)39(9)15-11-13-37(5,6)32(39)21-41/h17-23,32-36,42-43H,11-16H2,1-10H3/t32-,33+,34-,35-,36+,39+,40+/m0/s1",CC(C)c1cc([C@H]2O[C@H]3[C@H](O2)c2cc(C(C)C)c(O)cc2[C@@]2(C)CCCC(C)(C)[C@H]32)c([C@@]2(C)CCCC(C)(C)[C@@H]2C=O)cc1O,C40H56O5,,616.412774892,MWDFPCUZRNPYPD,Terpenoids,Diterpenoids,Abietane diterpenoids,Conchidium japonicum,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,1,5.524529576301575 5867,2987,1673,,,,0.39367396,ISDB,,,,,,,AMXCMJDAXXAYMI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5746958255767822 5868,2984,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.2520164,ISDB,XFYJEZCEBAVINO-GGLMBGNOSA-N,"InChI=1S/C17H26O3/c1-11(10-19-13(3)18)9-14-6-5-12(2)15-7-8-16(4)17(14,15)20-16/h9,12,14-15H,5-8,10H2,1-4H3/b11-9+/t12-,14+,15-,16+,17-/m1/s1",CC(=O)OC/C(C)=C/[C@@H]1CC[C@@H](C)[C@H]2CC[C@]3(C)O[C@]123,C17H26O3,,278.188194692,XFYJEZCEBAVINO,Terpenoids,Sesquiterpenoids,Arteminisin,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,7.008065581321716 5869,2981,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.27969003,ISDB,MQPZZRJJCAGMTC-JSGUEGIKSA-N,"InChI=1S/C25H42O5/c1-8-17(3)22(28)30-20-15-18(4)23(5,13-11-16(2)14-21(26)27)19-10-9-12-24(6,29)25(19,20)7/h8,16,18-20,29H,9-15H2,1-7H3,(H,26,27)/b17-8-/t16-,18+,19+,20-,23-,24+,25-/m0/s1",C/C=C(/C)C(=O)O[C@H]1C[C@@H](C)[C@](C)(CC[C@H](C)CC(=O)O)[C@H]2CCC[C@@](C)(O)[C@]12C,C25H42O5,,422.303224444,MQPZZRJJCAGMTC,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Pteronia paniculata,7599757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Pteronia'],['Pteronia paniculata'],4,2,6.118760108947754 5870,2978,-1,,,,0.0,MS1_match,GEWDNTWNSAZUDX-WQMVXFAESA-N,"InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)OC,C13H20O3,pos_1_1proton1ammonium,224.1412445,GEWDNTWNSAZUDX,Fatty acids,Octadecanoids,Jasmonic acids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 5871,2978,-1,,,,0.0,MS1_match,FLCYLPQGSMGINE-UJWYFFHYSA-N,"InChI=1S/C26H43NO6/c1-6-15-21-23(13-28)9-8-18(32-4)25(21)16-10-14-17(31-3)11-24(29,19(16)20(14)33-5)26(15,30)22(25)27(7-2)12-23/h14-22,28-30H,6-13H2,1-5H3/t14-,15+,16-,17+,18+,19-,20+,21-,22+,23+,24-,25+,26-/m1/s1",CC[C@H]1[C@@H]2[C@@]3(CO)CC[C@H](OC)[C@@]24[C@@H]2C[C@H]5[C@H](OC)[C@@H]2[C@](O)(C[C@@H]5OC)[C@]1(O)[C@H]4N(CC)C3,C26H43NO6,pos_2_2proton1ammonium,465.3090380959999,FLCYLPQGSMGINE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 5872,2978,-1,,,,0.0,MS1_match,FLCYLPQGSMGINE-UJWYFFHYSA-N,"InChI=1S/C26H43NO6/c1-6-15-21-23(13-28)9-8-18(32-4)25(21)16-10-14-17(31-3)11-24(29,19(16)20(14)33-5)26(15,30)22(25)27(7-2)12-23/h14-22,28-30H,6-13H2,1-5H3/t14-,15+,16-,17+,18+,19-,20+,21-,22+,23+,24-,25+,26-/m1/s1",CC[C@H]1[C@@H]2[C@@]3(CO)CC[C@H](OC)[C@@]24[C@@H]2C[C@H]5[C@H](OC)[C@@H]2[C@](O)(C[C@@H]5OC)[C@]1(O)[C@H]4N(CC)C3,C26H43NO6,pos_2_2proton1ammonium,465.3090380959999,FLCYLPQGSMGINE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 5873,2978,-1,,,,0.0,MS1_match,ORBNFGSLPINTIF-QPVXARCPSA-N,"InChI=1S/C26H43NO6/c1-7-27-12-24(13-28)9-8-17(30-3)26-15-10-14-16(29-2)11-25(33-6,18(15)20(14)31-4)19(23(26)27)21(32-5)22(24)26/h14-23,28H,7-13H2,1-6H3/t14-,15-,16+,17-,18-,19-,20-,21-,22+,23+,24-,25-,26-/m1/s1",CCN1C[C@@]2(CO)CC[C@@H](OC)[C@]34[C@@H]5C[C@H]6[C@@H](OC)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@H]([C@@H](OC)[C@@H]23)[C@H]14,C26H43NO6,pos_2_2proton1ammonium,465.309038096,ORBNFGSLPINTIF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,0,6.0 5874,2976,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.8351932,ISDB,DTOSIQBPPRVQHS-IUQGRGSQSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3+,7-6+,10-9+",CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)O,C18H30O2,,278.2245802,DTOSIQBPPRVQHS,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,3,10.840772867202759 5875,2975,-1,,,,0.64859277,ISDB,,,,,,,ORDIPLSZZYDBSA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.5943710803985596 5876,2972,432,Terpenoids,Sesquiterpenoids,Menthane monoterpenoids,0.20991515,ISDB,VESROWPDCSMBRM-RMTQGBGSSA-N,"InChI=1S/C14H22O2/c1-9-4-5-11(8-10(2)15)14-12(9)6-7-13(14,3)16-14/h9,11-12H,4-8H2,1-3H3/t9-,11+,12-,13+,14-/m1/s1",CC(=O)C[C@@H]1CC[C@@H](C)[C@H]2CC[C@]3(C)O[C@]123,C14H22O2,,222.161979944,VESROWPDCSMBRM,Terpenoids,Sesquiterpenoids,Arteminisin,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.839660584926605 5877,2969,-1,,,,0.2623835,ISDB,TVXHJNAIUTYXAK-WWXAJPEWSA-N,"InChI=1S/C19H30O4/c1-12(11-17(22)23)5-6-13-14(20)7-8-15-18(2,3)16(21)9-10-19(13,15)4/h11,13,15-16,21H,5-10H2,1-4H3,(H,22,23)/b12-11-/t13-,15-,16-,19+/m1/s1",C/C(=C/C(=O)O)CC[C@@H]1C(=O)CC[C@@H]2C(C)(C)[C@H](O)CC[C@@]12C,C19H30O4,,322.21440944,TVXHJNAIUTYXAK,Terpenoids,Diterpenoids,Norlabdane diterpenoids,Ayapana amygdalina,156326.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Ayapana'],['Ayapana amygdalina'],4,0,5.04953396320343 5878,2967,-1,,,,0.21684259,ISDB,,,,,,,UEWALUCYMCDVGT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8673703670501709 5879,2964,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.2475022,ISDB,RGAZJYSRPZSBTF-GVVOHZSFSA-N,"InChI=1S/C40H52O2/c1-29(18-13-20-31(3)23-25-35-33(5)22-15-27-39(35,7)8)16-11-12-17-30(2)19-14-21-32(4)24-26-36-34(6)38(42)37(41)28-40(36,9)10/h11-14,16-21,23-26,28,41H,15,22,27H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,29-16+,30-17+,31-20+,32-21+",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)C(O)=CC2(C)C)C(C)(C)CCC1,C40H52O2,,564.396730904,RGAZJYSRPZSBTF,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Adonis annua,804994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis annua'],6,3,8.490008771419525 5880,2963,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.80211085,ISDB,KBGYPXOSNDMZRV-UHFFFAOYSA-N,"InChI=1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,6-7,9-10H,2,5,8,11-15H2,1H3,(H,17,18)",CCC=CCC=CCC=CCCCCCC(=O)O,C16H26O2,,250.193280072,KBGYPXOSNDMZRV,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Apium graveolens,2472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,3,8.708443403244019 5881,2963,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.80211085,ISDB,KBGYPXOSNDMZRV-IUQGRGSQSA-N,"InChI=1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,6-7,9-10H,2,5,8,11-15H2,1H3,(H,17,18)/b4-3+,7-6+,10-9+",CC/C=C/C/C=C/C/C=C/CCCCCC(=O)O,C16H26O2,,250.193280072,KBGYPXOSNDMZRV,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,3,8.708443403244019 5882,2962,-1,,,,0.34157482,ISDB,XXZAOMJCZBZKPV-WEDXCCLWSA-N,"InChI=1S/C10H17Cl/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8H,4-6H2,1-3H3/t7-,8+,10+/m1/s1",CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](Cl)C2,C10H17Cl,,172.101878224,XXZAOMJCZBZKPV,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Thymbra capitata,27200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymbra'],['Thymbra capitata'],4,0,5.366299271583557 5883,2962,-1,,,,0.34157482,ISDB,XXZAOMJCZBZKPV-WEDXCCLWSA-N,"InChI=1S/C10H17Cl/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8H,4-6H2,1-3H3/t7-,8+,10+/m1/s1",CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](Cl)C2,C10H17Cl,,172.101878224,XXZAOMJCZBZKPV,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Thymus martinezii,27200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymbra'],['Thymbra capitata'],4,0,5.366299271583557 5884,2962,-1,,,,0.34157482,ISDB,XXZAOMJCZBZKPV-WEDXCCLWSA-N,"InChI=1S/C10H17Cl/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8H,4-6H2,1-3H3/t7-,8+,10+/m1/s1",CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](Cl)C2,C10H17Cl,,172.101878224,XXZAOMJCZBZKPV,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Thymus capitatus,27200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymbra'],['Thymbra capitata'],4,0,5.366299271583557 5885,2956,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1isopropanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5886,2956,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1isopropanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 5887,2956,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1isopropanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,0,6.0 5888,2956,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1isopropanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5889,2956,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_1_1proton1isopropanol,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,0,6.0 5890,2955,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.3858026,ISDB,FQIQQNIQIRUWGC-GFCCVEGCSA-N,"InChI=1S/C15H17NO4/c1-15(2)12(18)7-10-13(19)9-6-8(17)4-5-11(9)16(3)14(10)20-15/h4-6,12,17-18H,7H2,1-3H3/t12-/m1/s1",Cn1c2c(c(=O)c3cc(O)ccc31)C[C@@H](O)C(C)(C)O2,C15H17NO4,,275.115758024,FQIQQNIQIRUWGC,Alkaloids,Anthranilic acid alkaloids,Acridone alkaloids,Balfourodendron riedelianum,974695.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Balfourodendron'],['Balfourodendron riedelianum'],4,1,6.043210387229919 5891,2952,-1,,,,0.4969879,ISDB,CPFUJAKVJBYWJA-BTRWLOMLSA-N,"InChI=1S/C29H36O4/c1-17-9-10-29(25(32)33-6)14-13-27(4)22-8-7-19-18(2)24(31)21(30)16-20(19)26(22,3)11-12-28(27,5)23(29)15-17/h7-8,16,23,31H,1,9-15H2,2-6H3/t23-,26-,27+,28-,29-/m0/s1",C=C1CC[C@]2(C(=O)OC)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C29H36O4,,448.261359632,CPFUJAKVJBYWJA,Terpenoids,Triterpenoids,Lupane triterpenoids,Salacia kraussii,981087.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia kraussii'],4,0,5.987951636314392 5892,2949,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,ATFJUGCMEQBNLH-UHFFFAOYSA-N,"InChI=1S/C10H14O5/c1-10-6(12)2-4-5(3-11)9(15-10)14-8(13)7(4)10/h4-7,9,11-12H,2-3H2,1H3",CC12OC3OC(=O)C1C(CC2O)C3CO,C10H14O5,pos_2MHCH3CN,214.084123548,ATFJUGCMEQBNLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 5893,2948,1134,Fatty acids,Diterpenoids,Glycerophosphocholines,0.0,MS1_match,LJYHBQXTZDRJST-BKLVVLCVSA-N,"InChI=1S/C19H24O6/c1-9(2)11-7-19(23)17-10(16(11)22)4-5-13-12(8-20)14(21)6-15(24-25-19)18(13,17)3/h7,9,12-13,15,20,23H,4-6,8H2,1-3H3/t12-,13+,15-,18-,19-/m1/s1",CC(C)C1=C[C@@]2(O)OO[C@@H]3CC(=O)[C@H](CO)[C@@H]4CCC(=C2[C@@]34C)C1=O,C19H24O6,pos_2MCH3CNNa,348.157288488,LJYHBQXTZDRJST,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,2,7.0 5894,2941,-1,,,,0.36464697,ISDB,HFPZCAJZSCWRBC-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3",Cc1ccc(C(C)C)cc1,C10H14,,134.109550448,HFPZCAJZSCWRBC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,7.458587884902954 5895,2938,-1,,,,0.529178,ISDB,KAUFDVDLVRIRJS-OTIJZXASSA-N,"InChI=1S/C30H42O10/c1-17(12-14-37-19-8-6-18-7-10-24(32)38-20(18)15-19)5-9-22-29(2,3)23(11-13-30(22,4)36)40-28-27(35)26(34)25(33)21(16-31)39-28/h6-8,10,12,15,21-23,25-28,31,33-36H,5,9,11,13-14,16H2,1-4H3/b17-12+/t21-,22-,23-,25-,26+,27-,28+,30+/m1/s1",C/C(=C\COc1ccc2ccc(=O)oc2c1)CC[C@@H]1C(C)(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC[C@]1(C)O,C30H42O10,,562.277797544,KAUFDVDLVRIRJS,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ferula gummosa,164046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Ferula'],['Ferula gummosa'],4,0,6.1167120933532715 5896,2938,-1,,,,0.529178,ISDB,KAUFDVDLVRIRJS-OTIJZXASSA-N,"InChI=1S/C30H42O10/c1-17(12-14-37-19-8-6-18-7-10-24(32)38-20(18)15-19)5-9-22-29(2,3)23(11-13-30(22,4)36)40-28-27(35)26(34)25(33)21(16-31)39-28/h6-8,10,12,15,21-23,25-28,31,33-36H,5,9,11,13-14,16H2,1-4H3/b17-12+/t21-,22-,23-,25-,26+,27-,28+,30+/m1/s1",C/C(=C\COc1ccc2ccc(=O)oc2c1)CC[C@@H]1C(C)(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC[C@]1(C)O,C30H42O10,,562.277797544,KAUFDVDLVRIRJS,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ferula ovina,131374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Ferula'],['Ferula ovina'],4,0,6.1167120933532715 5897,2938,-1,,,,0.529178,ISDB,KAUFDVDLVRIRJS-OTIJZXASSA-N,"InChI=1S/C30H42O10/c1-17(12-14-37-19-8-6-18-7-10-24(32)38-20(18)15-19)5-9-22-29(2,3)23(11-13-30(22,4)36)40-28-27(35)26(34)25(33)21(16-31)39-28/h6-8,10,12,15,21-23,25-28,31,33-36H,5,9,11,13-14,16H2,1-4H3/b17-12+/t21-,22-,23-,25-,26+,27-,28+,30+/m1/s1",C/C(=C\COc1ccc2ccc(=O)oc2c1)CC[C@@H]1C(C)(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC[C@]1(C)O,C30H42O10,,562.277797544,KAUFDVDLVRIRJS,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ferula kopetdagensis,3888267.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Ferula'],['Ferula kopetdagensis'],4,0,6.1167120933532715 5898,2937,248,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,QUKURLODOVRHQB-CSIVPCFASA-N,"InChI=1S/C23H37NO9/c1-24-7-20(8-31-2)10(25)5-11(32-3)22-9-6-21(29)17(26)12(9)23(30,19(28)18(21)27)13(16(22)24)14(33-4)15(20)22/h9-19,25-30H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14+,15-,16-,17-,18+,19+,20+,21-,22+,23-/m1/s1",COC[C@]12CN(C)[C@@H]3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](O)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2O,C23H37NO9,pos_1_1proton1methanol,471.2468317639998,QUKURLODOVRHQB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 5899,2936,115,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,CCTSZLOYMHLMHP-UHFFFAOYSA-N,"InChI=1S/C10H16O5/c1-10(14)7(12)2-6-5(3-11)4-15-9(13)8(6)10/h5-8,11-12,14H,2-4H2,1H3",CC1(O)C(O)CC2C(CO)COC(=O)C21,C10H16O5,pos_2MNa,216.099773612,CCTSZLOYMHLMHP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 5900,2935,713,Terpenoids,,,0.28481978,ISDB,YFSJBBMDQKSVOR-BUSNQDHMSA-N,"InChI=1S/C36H44O10/c1-18-7-8-21-31(42)26(45-6)14-28(41)36(21,29-13-24(40)30-23(39)11-19(37)12-25(30)46-29)22(18)17-35(44)33(4)16-20(38)15-32(2,3)27(33)9-10-34(35,5)43/h7,11-14,20-22,27,37-39,43-44H,8-10,15-17H2,1-6H3/t20-,21-,22+,27-,33-,34+,35-,36-/m0/s1",COC1=CC(=O)[C@@]2(c3cc(=O)c4c(O)cc(O)cc4o3)[C@H](C[C@]3(O)[C@@]4(C)C[C@@H](O)CC(C)(C)[C@@H]4CC[C@@]3(C)O)C(C)=CC[C@H]2C1=O,C36H44O10,,636.293447608,YFSJBBMDQKSVOR,Terpenoids,,,Stachys cinerea,7629252.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Stachys'],['Stachys cinerea'],4,1,5.639279127120972 5901,2935,713,Terpenoids,,,0.28481978,ISDB,YFSJBBMDQKSVOR-BUSNQDHMSA-N,"InChI=1S/C36H44O10/c1-18-7-8-21-31(42)26(45-6)14-28(41)36(21,29-13-24(40)30-23(39)11-19(37)12-25(30)46-29)22(18)17-35(44)33(4)16-20(38)15-32(2,3)27(33)9-10-34(35,5)43/h7,11-14,20-22,27,37-39,43-44H,8-10,15-17H2,1-6H3/t20-,21-,22+,27-,33-,34+,35-,36-/m0/s1",COC1=CC(=O)[C@@]2(c3cc(=O)c4c(O)cc(O)cc4o3)[C@H](C[C@]3(O)[C@@]4(C)C[C@@H](O)CC(C)(C)[C@@H]4CC[C@@]3(C)O)C(C)=CC[C@H]2C1=O,C36H44O10,,636.293447608,YFSJBBMDQKSVOR,Terpenoids,,,Dichrostachys cinerea,581363.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Mimoseae'],['Dichrostachys'],['Dichrostachys cinerea'],4,1,5.639279127120972 5902,2935,713,Terpenoids,,,0.28481978,ISDB,YFSJBBMDQKSVOR-BUSNQDHMSA-N,"InChI=1S/C36H44O10/c1-18-7-8-21-31(42)26(45-6)14-28(41)36(21,29-13-24(40)30-23(39)11-19(37)12-25(30)46-29)22(18)17-35(44)33(4)16-20(38)15-32(2,3)27(33)9-10-34(35,5)43/h7,11-14,20-22,27,37-39,43-44H,8-10,15-17H2,1-6H3/t20-,21-,22+,27-,33-,34+,35-,36-/m0/s1",COC1=CC(=O)[C@@]2(c3cc(=O)c4c(O)cc(O)cc4o3)[C@H](C[C@]3(O)[C@@]4(C)C[C@@H](O)CC(C)(C)[C@@H]4CC[C@@]3(C)O)C(C)=CC[C@H]2C1=O,C36H44O10,,636.293447608,YFSJBBMDQKSVOR,Terpenoids,,,Stachys germanica,291074.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Stachys'],['Stachys germanica'],4,1,5.639279127120972 5903,2934,186,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SCTDPJFVWAWKPB-JBKQMOEBSA-N,"InChI=1S/C24H28O10/c25-8-17-19(26)20(27)21(28)24(33-17)34-23-18-13(15(10-32-23)22(29)30)6-12-7-16(18)31-9-14(12)11-4-2-1-3-5-11/h1-5,9-10,12-13,16-21,23-28H,6-8H2,(H,29,30)/t12-,13-,16-,17-,18+,19-,20+,21-,23+,24+/m1/s1",O=C(O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C[C@@H]1C[C@H]2OC=C1c1ccccc1,C24H28O10,pos_2_2proton2acetonitrile,476.1682470959998,SCTDPJFVWAWKPB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 5904,2925,729,Terpenoids,Diterpenoids,Abietane diterpenoids,0.21669205,ISDB,UAEUNTXALQHLMF-UWJYYQICSA-N,"InChI=1S/C21H28O3/c1-12(2)14-6-9-18-16(19(14)24-5)7-8-17-13(3)15(20(22)23)10-11-21(17,18)4/h6,9,12,17H,7-8,10-11H2,1-5H3,(H,22,23)/t17-,21-/m0/s1",COc1c(C(C)C)ccc2c1CC[C@H]1C(C)=C(C(=O)O)CC[C@]21C,C21H28O3,,328.203844756,UAEUNTXALQHLMF,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],4,3,6.366768181324005 5905,2925,729,Terpenoids,Diterpenoids,Abietane diterpenoids,0.21669205,ISDB,UAEUNTXALQHLMF-UHFFFAOYSA-N,"InChI=1S/C21H28O3/c1-12(2)14-6-9-18-16(19(14)24-5)7-8-17-13(3)15(20(22)23)10-11-21(17,18)4/h6,9,12,17H,7-8,10-11H2,1-5H3,(H,22,23)",COc1c(C(C)C)ccc2c1CCC1C(C)=C(C(=O)O)CCC21C,C21H28O3,,328.203844756,UAEUNTXALQHLMF,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],4,3,6.366768181324005 5906,2921,907,Fatty acids,Sphingolipids,Phytane diterpenoids,0.34953848,ISDB,,,,,,,AVXDNDYYTSRSJJ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3981539011001587 5907,2917,-1,,,,0.5893819,ISDB,OMHJQGZJZUFMMT-AJHRVBBASA-N,"InChI=1S/C27H34O3/c28-19-11-8-17(9-12-19)6-4-2-1-3-5-7-20-21-14-15-22-23(27(29)30)13-10-18-16-24(20)26(21)25(18)22/h8-15,18,20-26,28H,1-7,16H2,(H,29,30)/t18-,20-,21-,22+,23-,24+,25-,26-/m1/s1",O=C(O)[C@@H]1C=C[C@@H]2C[C@H]3[C@H](CCCCCCCc4ccc(O)cc4)[C@H]4C=C[C@@H]1[C@@H]2[C@H]43,C27H34O3,,406.250794948,OMHJQGZJZUFMMT,,,,Beilschmiedia ferruginea,6025446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Beilschmiedia'],['Beilschmiedia ferruginea'],4,0,6.357527494430542 5908,2915,-1,,,,0.0,MS1_match,WZDQZUZGMJUYFF-ZZQRAECTSA-N,"InChI=1S/C25H34O8/c1-14(2)7-20(26)29-11-17-12-30-24(33-22(28)9-16(5)6)23-18(17)10-19(25(23)13-31-25)32-21(27)8-15(3)4/h9-10,12,14-15,19,23-24H,7-8,11,13H2,1-6H3/t19-,23+,24-,25+/m0/s1",CC(C)=CC(=O)O[C@@H]1OC=C(COC(=O)CC(C)C)C2=C[C@H](OC(=O)CC(C)C)[C@]3(CO3)[C@H]21,C25H34O8,pos_1_1proton1isopropanol,462.2253680479999,WZDQZUZGMJUYFF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 5909,2910,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.44263852,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Guapira graciliflora,6038299.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Nyctaginaceae'],['Unknown'],['Guapira'],['Guapira graciliflora'],4,2,6.770554065704346 5910,2910,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.44263852,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Zingiber officinale,1063866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Zingiber'],['Zingiber officinale'],4,2,6.770554065704346 5911,2910,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.44263852,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Sonchus arvensis,761934.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus arvensis'],4,2,6.770554065704346 5912,2910,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.44263852,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Sonchus mauritanicus,572923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus mauritanicus'],4,2,6.770554065704346 5913,2910,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.44263852,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Premna microphylla,503286.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Premna'],['Premna microphylla'],4,2,6.770554065704346 5914,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,3,7.5 5915,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,3,7.5 5916,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 5917,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 5918,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,3,7.5 5919,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 5920,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 5921,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,7.5 5922,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,3,7.5 5923,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,3,7.5 5924,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 5925,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,3,7.5 5926,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,3,7.5 5927,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,3,7.5 5928,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 5929,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,3,7.5 5930,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,3,7.5 5931,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,3,7.5 5932,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,3,7.5 5933,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,3,7.5 5934,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 5935,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,3,7.5 5936,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 5937,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,3,7.5 5938,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,3,7.5 5939,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,3,7.5 5940,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,3,7.5 5941,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KQEOKUJOWVGWDX-QFOSDGOKSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17-,20-,21-,22+/m1/s1",CC(=O)OCC1=CO[C@H](OC(=O)CC(C)C)[C@H]2[C@@H]1C[C@@H](OC(=O)CC(C)C)[C@@]21CO1,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,KQEOKUJOWVGWDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 5942,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,3,7.5 5943,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PVKOJQHHDYMUEI-RCUFNAHASA-N,"InChI=1S/C22H32O8/c1-12(2)6-15(24)9-26-17-10-27-21(30-19(25)7-13(3)4)20-16(17)8-18(29-14(5)23)22(20)11-28-22/h10,12-13,16,18,20-21H,6-9,11H2,1-5H3/t16-,18+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(OCC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PVKOJQHHDYMUEI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 5944,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GXDIBKDQQDPOBI-BHIFYINESA-N,"InChI=1S/C22H32O8/c1-6-27-12-22(26)17(23)9-16-15(10-28-18(24)7-13(2)3)11-29-21(20(16)22)30-19(25)8-14(4)5/h9,11,13-14,20-21,26H,6-8,10,12H2,1-5H3/t20-,21+,22-/m1/s1",CCOC[C@@]1(O)C(=O)C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]21,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,GXDIBKDQQDPOBI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 5945,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,3,7.5 5946,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,3,7.5 5947,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,3,7.5 5948,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,3,7.5 5949,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 5950,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 5951,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,3,7.5 5952,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 5953,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 5954,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,7.5 5955,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,3,7.5 5956,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,3,7.5 5957,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 5958,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,3,7.5 5959,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,3,7.5 5960,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,3,7.5 5961,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 5962,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,3,7.5 5963,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,3,7.5 5964,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,3,7.5 5965,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,3,7.5 5966,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,3,7.5 5967,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 5968,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,3,7.5 5969,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 5970,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,3,7.5 5971,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,3,7.5 5972,2908,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,3,7.5 5973,2902,-1,,,,0.0,MS1_match,LERLQQKAXDNEKW-ZKMOHVOUSA-N,"InChI=1S/C22H34O8/c1-12(2)7-17(24)28-11-15-20-16(26-5)9-14(10-23)19(20)22(30-21(15)27-6)29-18(25)8-13(3)4/h9,12-13,16,19,21-23H,7-8,10-11H2,1-6H3/t16-,19-,21+,22-/m1/s1",CO[C@H]1O[C@@H](OC(=O)CC(C)C)[C@@H]2C(CO)=C[C@@H](OC)C2=C1COC(=O)CC(C)C,C22H34O8,pos_2_1proton1sodium,426.225368048,LERLQQKAXDNEKW,Terpenoids,Sesquiterpenoids,,Patrinia saniculifolia,139326.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia saniculifolia'],6,0,6.0 5974,2901,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.572335,ISDB,VHFYCADQVMYJEI-OCCSQVGLSA-N,"InChI=1S/C14H22/c1-10(2)13-8-7-12-6-4-5-11(3)14(12)9-13/h12,14H,3-9H2,1-2H3/t12-,14+/m1/s1",C=C1CCC[C@@H]2CCC(=C(C)C)C[C@@H]12,C14H22,,190.172150704,VHFYCADQVMYJEI,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Trichogonia salviifolia,5739079.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Trichogonia'],['Trichogonia salviifolia'],4,3,7.789340019226074 5975,2899,-1,,,,0.0,MS1_match,ZNWRRCQYVMGMGC-NBGZLQLJSA-N,"InChI=1S/C30H49ClO2/c1-19(9-12-25(33)27(4,5)31)20-13-17-30(8)22-10-11-23-26(2,3)24(32)15-16-28(23,6)21(22)14-18-29(20,30)7/h10,19-21,23,25,33H,9,11-18H2,1-8H3/t19-,20-,21-,23-,25-,28+,29+,30-/m0/s1",C[C@@H](CC[C@H](O)C(C)(C)Cl)[C@@H]1CC[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C,C30H49ClO2,pos_2MK,476.342108488,ZNWRRCQYVMGMGC,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Tripterygium doianum,293273.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium doianum'],6,0,6.0 5976,2898,-1,,,,0.25038695,ISDB,GDNJHSLMSYVKFX-KBPBESRZSA-N,"InChI=1S/C16H20O4/c1-16(2,19)14(20-3)9-10-8-13(17)11-6-4-5-7-12(11)15(10)18/h4-7,9,13-14,17,19H,8H2,1-3H3/t13-,14-/m0/s1",CO[C@@H](C=C1C[C@H](O)c2ccccc2C1=O)C(C)(C)O,C16H20O4,,276.13615912,GDNJHSLMSYVKFX,Polyketides,Naphthalenes,Naphthoquinones,Catalpa ovata,309390.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Catalpeae'],['Catalpa'],['Catalpa ovata'],4,0,5.001547813415527 5977,2895,-1,,,,0.35077786,ISDB,DHOXZZVHZKDVKN-FGGGPQFZSA-N,"InChI=1S/C28H54O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(2)25-31-26-28(30)24-29/h19-20,25,28-30H,3-18,21-24,26H2,1-2H3/b20-19-,27-25+/t28-/m0/s1",CCCCCCCCCCCCCCCCC/C=C\CCC/C(C)=C/OC[C@@H](O)CO,C28H54O3,,438.407295588,DHOXZZVHZKDVKN,Fatty acids,Glycerolipids,Monoacylglycerols,Stylissa carteri,561241.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Axinellida'],['Axinellidae'],['Unknown'],['Stylissa'],['Stylissa carteri'],1,0,2.403111457824707 5978,2893,-1,,,,0.0,MS1_match,LLINHWDEBZOLGN-UNQYGWCUSA-N,"InChI=1S/C28H36O4/c1-16-17-7-8-20-25(3,18(17)13-19(29)23(16)31)10-12-27(5)21-14-28(6,32)22(30)15-24(21,2)9-11-26(20,27)4/h7-8,13,21,31-32H,9-12,14-15H2,1-6H3/t21-,24+,25+,26-,27+,28+/m1/s1",CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)C(=O)C[C@]3(C)CC[C@]12C,C28H36O4,pos_2_2proton,436.261359632,LLINHWDEBZOLGN,Terpenoids,Triterpenoids,,Euonymus tingens,169628.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus tingens'],7,0,7.0 5979,2888,-1,,,,0.7079338,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,0,6.831735134124756 5980,2886,1374,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,0.5357422,ISDB,YEUIANWBIIZWTM-KORLLVGLSA-N,"InChI=1S/C30H46O4/c1-16(2)17-9-10-20-28(6)14-19(32)24-25(29(28,7)15-23(34)30(17,20)8)18(31)13-21-26(3,4)22(33)11-12-27(21,24)5/h16-17,20-23,33-34H,9-15H2,1-8H3/t17-,20+,21+,22-,23-,27+,28+,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=C(C(=O)C[C@@]21C)[C@@]1(C)CC[C@@H](O)C(C)(C)[C@@H]1CC3=O,C30H46O4,,470.339609952,YEUIANWBIIZWTM,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,10.642968893051147 5981,2885,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.3732907,ISDB,CSWYLIDLQDJVCQ-WYSBIKLGSA-N,"InChI=1S/C35H52O6/c1-21(2)13-12-18-33(11)25(16-14-22(3)4)19-34-20-27(32(9,10)41-39)40-30(34)26(17-15-23(5)6)29(37)35(33,31(34)38)28(36)24(7)8/h13-15,24-25,27,39H,12,16-20H2,1-11H3/t25-,27-,33+,34-,35-/m0/s1",CC(C)=CCC[C@]1(C)[C@@H](CC=C(C)C)C[C@]23C[C@@H](C(C)(C)OO)OC2=C(CC=C(C)C)C(=O)[C@@]1(C(=O)C(C)C)C3=O,C35H52O6,,568.376389384,CSWYLIDLQDJVCQ,Polyketides,Meroterpenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),Hypericum perforatum,618681.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum perforatum'],4,3,6.993162751197815 5982,2879,-1,,,,0.22727174,ISDB,WUCJZZPXANOCFR-UHFFFAOYSA-N,"InChI=1S/C27H44O4/c1-16(15-28)5-8-23(30)17(2)25-24(31)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16-22,25,28-29H,5-15H2,1-4H3",CC(CO)CCC(=O)C(C)C1C(=O)CC2C3CCC4CC(O)CCC4(C)C3CCC21C,C27H44O4,,432.32395988799993,WUCJZZPXANOCFR,Terpenoids,Steroids,Cholestane steroids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,0,4.9090869426727295 5983,2878,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.33835608,ISDB,,,,,,,SJXHOVSBAHNRQL,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.353424310684204 5984,2877,433,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.60202456,ISDB,GQGXEILPTLCMFO-OCCSQVGLSA-N,"InChI=1S/C16H19NO5/c1-16(2)14(19)12(18)10-13(22-16)8-6-5-7-9(21-4)11(8)17(3)15(10)20/h5-7,12,14,18-19H,1-4H3/t12-,14+/m1/s1",COc1cccc2c3c(c(=O)n(C)c12)[C@@H](O)[C@H](O)C(C)(C)O3,C16H19NO5,,305.126322708,GQGXEILPTLCMFO,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum beecheyanum,743556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum beecheyanum'],4,3,7.908098220825195 5985,2877,433,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.60202456,ISDB,GQGXEILPTLCMFO-OCCSQVGLSA-N,"InChI=1S/C16H19NO5/c1-16(2)14(19)12(18)10-13(22-16)8-6-5-7-9(21-4)11(8)17(3)15(10)20/h5-7,12,14,18-19H,1-4H3/t12-,14+/m1/s1",COc1cccc2c3c(c(=O)n(C)c12)[C@@H](O)[C@H](O)C(C)(C)O3,C16H19NO5,,305.126322708,GQGXEILPTLCMFO,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Zanthoxylum simulans,889927.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum simulans'],4,3,7.908098220825195 5986,2877,433,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.60202456,ISDB,GQGXEILPTLCMFO-OCCSQVGLSA-N,"InChI=1S/C16H19NO5/c1-16(2)14(19)12(18)10-13(22-16)8-6-5-7-9(21-4)11(8)17(3)15(10)20/h5-7,12,14,18-19H,1-4H3/t12-,14+/m1/s1",COc1cccc2c3c(c(=O)n(C)c12)[C@@H](O)[C@H](O)C(C)(C)O3,C16H19NO5,,305.126322708,GQGXEILPTLCMFO,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Rauia resinosa,6126588.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Rauia'],['Rauia resinosa'],4,3,7.908098220825195 5987,2874,-1,,,,0.0,MS1_match,HCGUNEDCTVLVNP-HVLDEAOBSA-N,"InChI=1S/C27H38O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h10-11,13,15-16,21,25-26,32H,8-9,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H38O10,pos_2_2proton2acetonitrile,522.2464974159999,HCGUNEDCTVLVNP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 5988,2867,907,Fatty acids,Sphingolipids,Phytane diterpenoids,0.2501151,ISDB,SKUYODQAHZTUFS-LBFZIJHGSA-N,"InChI=1S/C35H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(38)32(31-37)36-35(40)34(39)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-34,37-39H,3-31H2,1-2H3,(H,36,40)/t32-,33+,34+/m0/s1",CCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCCCCC,C35H71NO4,,569.538309752,SKUYODQAHZTUFS,Fatty acids,Sphingolipids,Ceramides,Polyporus picipes,5300128.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Polyporales'],['Polyporaceae'],['Unknown'],['Polyporus'],['Polyporus picipes'],1,2,3.000460386276245 5989,2867,907,Fatty acids,Sphingolipids,Phytane diterpenoids,0.2501151,ISDB,SKUYODQAHZTUFS-UHFFFAOYSA-N,"InChI=1S/C35H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(38)32(31-37)36-35(40)34(39)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-34,37-39H,3-31H2,1-2H3,(H,36,40)",CCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)CCCCCCCCCCCCCCC,C35H71NO4,,569.538309752,SKUYODQAHZTUFS,Fatty acids,Sphingolipids,Ceramides,Polyporus badius,5684995.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Polyporales'],['Polyporaceae'],['Unknown'],['Polyporus'],['Polyporus badius'],1,2,3.000460386276245 5990,2867,907,Fatty acids,Sphingolipids,Phytane diterpenoids,0.2501151,ISDB,SKUYODQAHZTUFS-UHFFFAOYSA-N,"InChI=1S/C35H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(38)32(31-37)36-35(40)34(39)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-34,37-39H,3-31H2,1-2H3,(H,36,40)",CCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)CCCCCCCCCCCCCCC,C35H71NO4,,569.538309752,SKUYODQAHZTUFS,Fatty acids,Sphingolipids,Ceramides,Phellinus badius,33767.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Hymenochaetales'],['Hymenochaetaceae'],['Unknown'],['Phellinus'],['Phellinus badius'],1,2,3.000460386276245 5991,2867,907,Fatty acids,Sphingolipids,Phytane diterpenoids,0.2501151,ISDB,SKUYODQAHZTUFS-UHFFFAOYSA-N,"InChI=1S/C35H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(38)32(31-37)36-35(40)34(39)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-34,37-39H,3-31H2,1-2H3,(H,36,40)",CCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)CCCCCCCCCCCCCCC,C35H71NO4,,569.538309752,SKUYODQAHZTUFS,Fatty acids,Sphingolipids,Ceramides,Nigroporus durus,3801673.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Polyporales'],['Polyporaceae'],['Unknown'],['Nigroporus'],['Nigroporus durus'],1,2,3.000460386276245 5992,2863,-1,,,,0.0,MS1_match,XXZPXRQPWFAXCK-WQFMGJDKSA-N,"InChI=1S/C17H26O5/c1-10(2)7-15(19)22-17-16-11(3)5-6-14(16)13(9-21-17)8-20-12(4)18/h9-11,14,16-17H,5-8H2,1-4H3/t11-,14+,16+,17-/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1CC[C@@H]2C,C17H26O5,pos_1_1proton1ammonium,310.178023932,XXZPXRQPWFAXCK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 5993,2861,222,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,OTMTZTOMTOXZLO-GDNCAEEVSA-N,"InChI=1S/C27H34O13/c1-34-16-6-12(4-5-15(16)39-26-23(32)22(31)21(30)19(9-28)40-26)24-14-10-37-25(27(14,33)11-38-24)13-7-17(35-2)20(29)18(8-13)36-3/h4-8,14,19,21-26,28-33H,9-11H2,1-3H3/t14-,19-,21-,22+,23-,24-,25-,26-,27-/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4cc(OC)c(O)c(OC)c4)OC[C@H]23)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C27H34O13,pos_1_sodium,566.199941148,OTMTZTOMTOXZLO,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 5994,2860,109,Terpenoids,Diterpenoids,Estrane steroids,0.2009615,ISDB,JMBKXUYCBVKSSY-DOTOQJQBSA-N,"InChI=1S/C17H22O3/c1-16(2)5-4-6-17(3)11-8-14(20)13(19)7-10(11)12(18)9-15(16)17/h7-8,15,19-20H,4-6,9H2,1-3H3/t15-,17+/m0/s1",CC1(C)CCC[C@]2(C)c3cc(O)c(O)cc3C(=O)C[C@@H]12,C17H22O3,,274.156894564,JMBKXUYCBVKSSY,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],4,2,5.803846001625061 5995,2860,109,Terpenoids,Diterpenoids,Estrane steroids,0.2009615,ISDB,JMBKXUYCBVKSSY-DOTOQJQBSA-N,"InChI=1S/C17H22O3/c1-16(2)5-4-6-17(3)11-8-14(20)13(19)7-10(11)12(18)9-15(16)17/h7-8,15,19-20H,4-6,9H2,1-3H3/t15-,17+/m0/s1",CC1(C)CCC[C@]2(C)c3cc(O)c(O)cc3C(=O)C[C@@H]12,C17H22O3,,274.156894564,JMBKXUYCBVKSSY,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Celastrus stephanotifolius,6092505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus stephanotifolius'],4,2,5.803846001625061 5996,2860,109,Terpenoids,Diterpenoids,Estrane steroids,0.2009615,ISDB,JMBKXUYCBVKSSY-DOTOQJQBSA-N,"InChI=1S/C17H22O3/c1-16(2)5-4-6-17(3)11-8-14(20)13(19)7-10(11)12(18)9-15(16)17/h7-8,15,19-20H,4-6,9H2,1-3H3/t15-,17+/m0/s1",CC1(C)CCC[C@]2(C)c3cc(O)c(O)cc3C(=O)C[C@@H]12,C17H22O3,,274.156894564,JMBKXUYCBVKSSY,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Azadirachta indica,481682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Azadirachta'],['Azadirachta indica'],4,2,5.803846001625061 5997,2851,100,Alkaloids,Naphthalenes,Naphthalenes and derivatives,0.47921693,ISDB,LWNCVZAIYGAIFG-UHFFFAOYSA-N,"InChI=1S/C17H17NO4/c1-9-8-12(19)18-15-13(9)16(21-3)10-6-5-7-11(20-2)14(10)17(15)22-4/h5-8H,1-4H3,(H,18,19)",COc1cccc2c(OC)c3c(C)cc(O)nc3c(OC)c12,C17H17NO4,,299.115758024,LWNCVZAIYGAIFG,Polyketides,Naphthalenes,Naphthalenes and derivatives,Annona dioica,3868512.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona dioica'],4,3,7.416867733001709 5998,2851,100,Alkaloids,Naphthalenes,Naphthalenes and derivatives,0.47921693,ISDB,LWNCVZAIYGAIFG-UHFFFAOYSA-N,"InChI=1S/C17H17NO4/c1-9-8-12(19)18-15-13(9)16(21-3)10-6-5-7-11(20-2)14(10)17(15)22-4/h5-8H,1-4H3,(H,18,19)",COc1cccc2c(OC)c3c(C)cc(O)nc3c(OC)c12,C17H17NO4,,299.115758024,LWNCVZAIYGAIFG,Polyketides,Naphthalenes,Naphthalenes and derivatives,Annona ambotay,3868511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona ambotay'],4,3,7.416867733001709 5999,2850,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7530836,ISDB,,,,,,,QQFSIGWYINAJOB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.0123343467712402 6000,2847,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.4140972,ISDB,RRWYPLCSLKEVAO-CQSZACIVSA-N,"InChI=1S/C20H21NO5/c1-24-15-10-12-6-9-21(19(23)26-3)14-11-20(7-4-13(22)5-8-20)17(16(12)14)18(15)25-2/h4-5,7-8,10,14H,6,9,11H2,1-3H3/t14-/m1/s1",COC(=O)N1CCc2cc(OC)c(OC)c3c2[C@H]1CC31C=CC(=O)C=C1,C20H21NO5,,355.141972772,RRWYPLCSLKEVAO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Annona purpurea,592770.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona purpurea'],4,3,7.156388759613037 6001,2847,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.4140972,ISDB,RRWYPLCSLKEVAO-UHFFFAOYSA-N,"InChI=1S/C20H21NO5/c1-24-15-10-12-6-9-21(19(23)26-3)14-11-20(7-4-13(22)5-8-20)17(16(12)14)18(15)25-2/h4-5,7-8,10,14H,6,9,11H2,1-3H3",COC(=O)N1CCc2cc(OC)c(OC)c3c2C1CC31C=CC(=O)C=C1,C20H21NO5,,355.141972772,RRWYPLCSLKEVAO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Annona mucosa,1092024.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona mucosa'],4,3,7.156388759613037 6002,2846,377,Polyketides,Aromatic polyketides,Catechols with side chains,0.4595324,ISDB,DWNSTHXHWNEYCU-UHFFFAOYSA-N,"InChI=1S/C24H38O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(26-2)23(21)24(25)27-3/h7-8,17,19-20H,4-6,9-16,18H2,1-3H3",CCCCC=CCCCCCCCCCc1cccc(OC)c1C(=O)OC,C24H38O3,,374.2820950759999,DWNSTHXHWNEYCU,Polyketides,Aromatic polyketides,Catechols with side chains,Knema laurina,206501.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Myristicaceae'],['Unknown'],['Knema'],['Knema laurina'],4,3,7.338129639625549 6003,2845,432,Terpenoids,Sesquiterpenoids,Menthane monoterpenoids,0.3815572,ISDB,DGDRPKUDABZVDM-UHFFFAOYSA-N,"InChI=1S/C13H18O3/c1-8(2)11-7-12(15-5)9(3)6-13(11)16-10(4)14/h6-8H,1-5H3",COc1cc(C(C)C)c(OC(C)=O)cc1C,C13H18O3,,222.125594436,DGDRPKUDABZVDM,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Baccharis dracunculifolia,482153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Baccharis'],['Baccharis dracunculifolia'],4,3,7.0262287855148315 6004,2841,-1,,,,0.0,MS1_match,PRCDDNKVZQBPNG-YBWZTWLNSA-N,"InChI=1S/C18H30O3/c1-11-9-14(20-12(2)19)15-17(11,5)10-13-7-8-18(15,6)21-16(13,3)4/h11,13-15H,7-10H2,1-6H3/t11-,13-,14-,15-,17-,18+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@@]2(C)C[C@H]3CC[C@](C)(OC3(C)C)[C@H]12,C18H30O3,pos_2MHNH3,294.21949482,PRCDDNKVZQBPNG,Terpenoids,Sesquiterpenoids,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6005,2840,-1,,,,0.7000979,ISDB,KPANTTZNWNQAGE-PVOYIKSTSA-N,"InChI=1S/C16H24O3/c1-9-5-7-15(3)12(9)13-11(6-8-16(15,4)18)10(2)14(17)19-13/h10-11,13,18H,5-8H2,1-4H3/t10-,11-,13-,15-,16-/m0/s1",CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@](C)(O)[C@@]2(C)CC1,C16H24O3,,264.172544628,KPANTTZNWNQAGE,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Cichorium pumilum,1085088.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Cichorium'],['Cichorium pumilum'],4,0,6.800391674041748 6006,2838,-1,,,,0.5706295,ISDB,FIGNHNKYVQYJHG-UHFFFAOYSA-N,"InChI=1S/C18H31NO3/c1-4-5-6-9-12-16(20)13-10-7-8-11-14-17(21)19-15-18(2,3)22/h7-8,11,14,22H,4-6,9-10,12-13,15H2,1-3H3,(H,19,21)",CCCCCCC(=O)CCC=CC=CC(=O)NCC(C)(C)O,C18H31NO3,,309.230393852,FIGNHNKYVQYJHG,Fatty acids,Fatty amides,N-acyl amines,Zanthoxylum ailanthoides,806818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum ailanthoides'],4,0,6.282517910003662 6007,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,3,7.5 6008,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,3,7.5 6009,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6010,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 6011,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,3,7.5 6012,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 6013,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 6014,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,7.5 6015,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,3,7.5 6016,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,3,7.5 6017,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6018,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,3,7.5 6019,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,3,7.5 6020,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,3,7.5 6021,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 6022,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,3,7.5 6023,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,3,7.5 6024,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,3,7.5 6025,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,3,7.5 6026,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,3,7.5 6027,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 6028,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,3,7.5 6029,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 6030,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,3,7.5 6031,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,3,7.5 6032,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,3,7.5 6033,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,3,7.5 6034,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KQEOKUJOWVGWDX-QFOSDGOKSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17-,20-,21-,22+/m1/s1",CC(=O)OCC1=CO[C@H](OC(=O)CC(C)C)[C@H]2[C@@H]1C[C@@H](OC(=O)CC(C)C)[C@@]21CO1,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,KQEOKUJOWVGWDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 6035,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,3,7.5 6036,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,3,7.5 6037,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GXDIBKDQQDPOBI-BHIFYINESA-N,"InChI=1S/C22H32O8/c1-6-27-12-22(26)17(23)9-16-15(10-28-18(24)7-13(2)3)11-29-21(20(16)22)30-19(25)8-14(4)5/h9,11,13-14,20-21,26H,6-8,10,12H2,1-5H3/t20-,21+,22-/m1/s1",CCOC[C@@]1(O)C(=O)C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]21,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,GXDIBKDQQDPOBI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 6038,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,3,7.5 6039,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,3,7.5 6040,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,3,7.5 6041,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,3,7.5 6042,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6043,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 6044,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,3,7.5 6045,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 6046,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 6047,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,7.5 6048,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,3,7.5 6049,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,3,7.5 6050,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PVKOJQHHDYMUEI-RCUFNAHASA-N,"InChI=1S/C22H32O8/c1-12(2)6-15(24)9-26-17-10-27-21(30-19(25)7-13(3)4)20-16(17)8-18(29-14(5)23)22(20)11-28-22/h10,12-13,16,18,20-21H,6-9,11H2,1-5H3/t16-,18+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(OCC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PVKOJQHHDYMUEI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6051,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,3,7.5 6052,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6053,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,3,7.5 6054,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 6055,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,3,7.5 6056,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,3,7.5 6057,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,3,7.5 6058,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,3,7.5 6059,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,3,7.5 6060,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 6061,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,3,7.5 6062,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 6063,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,3,7.5 6064,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,3,7.5 6065,2831,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,3,7.5 6066,2830,355,Terpenoids,Monoterpenoids,Simple phenolic acids,0.0,MS1_match,YPZQHCLBLRWNMJ-OPRDCNLKSA-N,"InChI=1S/C10H16O2/c1-4-10(3)6-5-9(12-10)8(2)7-11/h4,7-9H,1,5-6H2,2-3H3/t8-,9-,10-/m1/s1",C=C[C@]1(C)CC[C@H]([C@H](C)C=O)O1,C10H16O2,pos_1_1proton,168.115029752,YPZQHCLBLRWNMJ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6067,2827,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,CCRXMHCQWYVXTE-WJUHSGQWSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38?,39?,40-,43-,44-,45+,46+,47?/m0/s1",CC1(C)CCC2(C(=O)O[C@@H]3O[C@H](COC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O18,pos_2_1proton1sodium,928.5031655920002,CCRXMHCQWYVXTE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum tetrasepalum,548474.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tetrasepala'],7,3,8.5 6068,2827,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,CCRXMHCQWYVXTE-WJUHSGQWSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38?,39?,40-,43-,44-,45+,46+,47?/m0/s1",CC1(C)CCC2(C(=O)O[C@@H]3O[C@H](COC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C47H76O18,pos_2_1proton1sodium,928.5031655920002,CCRXMHCQWYVXTE,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum tetrasepalum,548474.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone tetrasepala'],7,3,8.5 6069,2827,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,RADJMOTZTBOWET-FBPHBQCHSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(58)59)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(44(4,21-50)27(43)9-12-46(28,45)6)64-40-37(65-39-36(57)34(55)31(52)25(19-49)62-39)32(53)26(20-60-40)63-38-35(56)33(54)30(51)24(18-48)61-38/h7,23-40,48-57H,8-21H2,1-6H3,(H,58,59)/t23-,24+,25+,26+,27-,28-,29-,30+,31+,32-,33-,34-,35+,36+,37+,38-,39-,40-,43+,44-,45-,46-,47-/m1/s1",CC1(C)CC[C@@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O[C@H]6OC[C@H](O[C@H]7O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]7O)[C@@H](O)[C@@H]6O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@H]2C1,C47H76O18,pos_2_1proton1sodium,928.503165592,RADJMOTZTBOWET,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla campanella,6131277.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla campanella'],7,3,8.5 6070,2827,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,VBLLFNXBZCUOKG-WLZWQNRMSA-N,"InChI=1S/C47H76O18/c1-42(2)13-15-47(41(58)59)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(44(4,21-50)27(43)9-12-46(28,45)6)63-40-37(30(52)24(51)20-60-40)65-39-35(57)33(55)36(26(19-49)62-39)64-38-34(56)32(54)31(53)25(18-48)61-38/h7,23-40,48-57H,8-21H2,1-6H3,(H,58,59)/t23-,24+,25-,26-,27-,28+,29+,30+,31-,32+,33-,34-,35-,36-,37-,38+,39+,40+,43+,44+,45+,46-,47+/m1/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@@]3(C)C(=CC[C@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@H]2C1,C47H76O18,pos_2_1proton1sodium,928.503165592,VBLLFNXBZCUOKG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla campanella,6131277.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla campanella'],7,3,8.5 6071,2827,428,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,XJYVXYVCCLMPFI-HKOWJECQSA-N,"InChI=1S/C47H76O18/c1-21-29(51)32(54)34(56)38(61-21)64-36-31(53)26(63-39-35(57)33(55)30(52)25(18-48)62-39)19-60-40(36)65-37-24(50)17-43(4)27(44(37,5)20-49)10-11-46(7)28(43)9-8-22-23-16-42(2,3)12-14-47(23,41(58)59)15-13-45(22,46)6/h8,21,23-40,48-57H,9-20H2,1-7H3,(H,58,59)/t21-,23-,24-,25+,26-,27+,28+,29-,30+,31-,32+,33-,34+,35+,36+,37-,38-,39-,40-,43-,44-,45+,46+,47-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3[C@@H](O)C[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C47H76O18,pos_2_1proton1sodium,928.503165592,XJYVXYVCCLMPFI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone coronaria,483258.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone coronaria'],7,3,8.5 6072,2826,560,Terpenoids,Steroids,Pregnane steroids,0.41637304,ISDB,XOUUZSVTQKJJSX-IHIZVTIOSA-N,"InChI=1S/C24H36O9/c1-14-8-10-19(11-9-14)24(6,12-7-13-25)33-23-22(32-18(5)28)21(31-17(4)27)20(15(2)29-23)30-16(3)26/h8,13,15,19-23H,7,9-12H2,1-6H3/t15-,19-,20+,21+,22-,23+,24+/m1/s1",CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@@H](C)O[C@@H](O[C@@](C)(CCC=O)[C@@H]2CC=C(C)CC2)[C@@H]1OC(C)=O,C24H36O9,,468.2359327319998,XOUUZSVTQKJJSX,Terpenoids,,,Carthamus lanatus,1066138.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Carthamus'],['Carthamus lanatus'],4,1,6.1654921770095825 6073,2825,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.22919166,ISDB,OTBKATNIYSZVJP-UHFFFAOYSA-N,"InChI=1S/C17H23NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h10-11H,4-9H2,1-3H3",COc1cc(CCC(=O)N2CCCCC2=O)cc(OC)c1OC,C17H23NO5,,321.157622836,OTBKATNIYSZVJP,Alkaloids,Lysine alkaloids,,Piper swartzianum,366805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper swartzianum'],4,1,5.41676664352417 6074,2825,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.22919166,ISDB,OTBKATNIYSZVJP-UHFFFAOYSA-N,"InChI=1S/C17H23NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h10-11H,4-9H2,1-3H3",COc1cc(CCC(=O)N2CCCCC2=O)cc(OC)c1OC,C17H23NO5,,321.157622836,OTBKATNIYSZVJP,Alkaloids,Lysine alkaloids,,Piper tuberculatum,443344.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper tuberculatum'],4,1,5.41676664352417 6075,2824,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.38414794,ISDB,XMDDGZCHKXAWPD-ZMDUCPJPSA-N,"InChI=1S/C42H83NO5/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-25-27-29-31-33-35-39(45)41(47)38(37-44)43-42(48)40(46)36-34-32-30-28-26-23-18-16-14-12-10-8-6-4-2/h32,34,38-41,44-47H,3-31,33,35-37H2,1-2H3,(H,43,48)/b34-32+/t38-,39+,40+,41-/m0/s1",CCCCCCCCCCCCC/C=C/C[C@@H](O)C(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C42H83NO5,,681.627124756,XMDDGZCHKXAWPD,Fatty acids,Sphingolipids,Ceramides,Pancovia laurentii,5748048.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Sapindaceae'],['Unknown'],['Pancovia'],['Pancovia laurentii'],4,2,6.5365917682647705 6076,2823,1250,Alkaloids,Triterpenoids,Isoquinoline alkaloids,0.3165793,ISDB,SFKCKJXMIAKQMY-QJERPKBESA-N,"InChI=1S/C55H74N4O6/c1-13-39-34(7)41-29-46-48(38(11)60)36(9)43(57-46)27-42-35(8)40(52(58-42)50-51(55(63)64-12)54(62)49-37(10)44(59-53(49)50)28-45(39)56-41)23-24-47(61)65-26-25-33(6)22-16-21-32(5)20-15-19-31(4)18-14-17-30(2)3/h13,25,27-32,34-35,40,51,57,59H,14-24,26H2,1-12H3/b33-25+,39-13-,41-29?,42-27?,43-27?,44-28?,45-28?,46-29?,52-50?/t31-,32-,34-,35+,40+,51-/m1/s1",C/C=C1\c2cc3[nH]c4c(c3C)C(=O)[C@H](C(=O)OC)c4c3nc(cc4[nH]c(cc(n2)[C@@H]1C)c(C(C)=O)c4C)[C@@H](C)[C@@H]3CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C,C55H74N4O6,,886.560836088,SFKCKJXMIAKQMY,Alkaloids,,,Blastochloris viridis,659978.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Alphaproteobacteria'],['Rhizobiales'],['Hyphomicrobiaceae'],['Unknown'],['Blastochloris'],['Blastochloris viridis'],0,1,1.7663172483444214 6077,2821,-1,,,,0.2689721,ISDB,MLHWAKJUYHPYIX-UEEGORRNSA-N,"InChI=1S/C24H38O7/c1-13-7-9-17(11-19-14(2)8-10-18(13)19)24(5,6)31-23-21(27)22(30-16(4)26)20(12-28-23)29-15(3)25/h14,17-23,27H,1,7-12H2,2-6H3/t14-,17+,18-,19-,20+,21-,22+,23+/m0/s1",C=C1CC[C@@H](C(C)(C)O[C@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2O)C[C@H]2[C@@H](C)CC[C@@H]12,C24H38O7,,438.261753556,MLHWAKJUYHPYIX,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Lessingia glandulifera,1062876.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Lessingia'],['Lessingia glandulifera'],4,0,5.075888395309448 6078,2819,-1,,,,0.0,MS1_match,CCTSZLOYMHLMHP-UHFFFAOYSA-N,"InChI=1S/C10H16O5/c1-10(14)7(12)2-6-5(3-11)4-15-9(13)8(6)10/h5-8,11-12,14H,2-4H2,1H3",CC1(O)C(O)CC2C(CO)COC(=O)C21,C10H16O5,pos_2MHNH3,216.099773612,CCTSZLOYMHLMHP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 6079,2817,-1,,,,0.7129026,ISDB,FHVJHEHGTUHWEN-GKEPGTTFSA-N,"InChI=1S/C20H36O/c1-15(11-14-21)9-12-19(4)17(3)10-13-20(5)16(2)7-6-8-18(19)20/h7,15,17-18,21H,6,8-14H2,1-5H3/t15?,17-,18-,19+,20+/m1/s1",CC1=CCC[C@@H]2[C@@](C)(CCC(C)CCO)[C@H](C)CC[C@@]12C,C20H36O,,292.276615772,FHVJHEHGTUHWEN,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Aristolochia ringens,603722.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia ringens'],4,0,6.851610422134399 6080,2817,-1,,,,0.7129026,ISDB,FHVJHEHGTUHWEN-GKEPGTTFSA-N,"InChI=1S/C20H36O/c1-15(11-14-21)9-12-19(4)17(3)10-13-20(5)16(2)7-6-8-18(19)20/h7,15,17-18,21H,6,8-14H2,1-5H3/t15?,17-,18-,19+,20+/m1/s1",CC1=CCC[C@@H]2[C@@](C)(CCC(C)CCO)[C@H](C)CC[C@@]12C,C20H36O,,292.276615772,FHVJHEHGTUHWEN,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Aristolochia galeata,867589.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia galeata'],4,0,6.851610422134399 6081,2817,-1,,,,0.7129026,ISDB,FHVJHEHGTUHWEN-GKEPGTTFSA-N,"InChI=1S/C20H36O/c1-15(11-14-21)9-12-19(4)17(3)10-13-20(5)16(2)7-6-8-18(19)20/h7,15,17-18,21H,6,8-14H2,1-5H3/t15?,17-,18-,19+,20+/m1/s1",CC1=CCC[C@@H]2[C@@](C)(CCC(C)CCO)[C@H](C)CC[C@@]12C,C20H36O,,292.276615772,FHVJHEHGTUHWEN,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Aristolochia labiata,493966.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia labiata'],4,0,6.851610422134399 6082,2816,-1,,,,0.3824755,ISDB,DHOXZZVHZKDVKN-FGGGPQFZSA-N,"InChI=1S/C28H54O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(2)25-31-26-28(30)24-29/h19-20,25,28-30H,3-18,21-24,26H2,1-2H3/b20-19-,27-25+/t28-/m0/s1",CCCCCCCCCCCCCCCCC/C=C\CCC/C(C)=C/OC[C@@H](O)CO,C28H54O3,,438.407295588,DHOXZZVHZKDVKN,Fatty acids,Glycerolipids,Monoacylglycerols,Stylissa carteri,561241.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Axinellida'],['Axinellidae'],['Unknown'],['Stylissa'],['Stylissa carteri'],1,0,2.5299019813537598 6083,2813,-1,,,,0.2605802,ISDB,SSJXRCYFOOLEKV-JNTJKXLSSA-N,"InChI=1S/C22H33NOS/c1-4-13-20(24-3)15-12-10-8-6-5-7-9-11-14-19-17-25-22(23-19)21-16-18(21)2/h4-6,8,10-11,14,18-21H,1,7,9,12-13,15-17H2,2-3H3/b6-5+,10-8+,14-11+/t18-,19?,20-,21+/m0/s1",C=CC[C@@H](CC/C=C/C=C/CC/C=C/C1CSC([C@@H]2C[C@@H]2C)=N1)OC,C22H33NOS,,359.228285676,SSJXRCYFOOLEKV,Polyketides,Linear polyketides,Open-chain polyketides,Lyngbya sordida,65081.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Lyngbya'],['Lyngbya sordida'],0,0,1.0423208475112915 6084,2813,-1,,,,0.2605802,ISDB,SSJXRCYFOOLEKV-JNTJKXLSSA-N,"InChI=1S/C22H33NOS/c1-4-13-20(24-3)15-12-10-8-6-5-7-9-11-14-19-17-25-22(23-19)21-16-18(21)2/h4-6,8,10-11,14,18-21H,1,7,9,12-13,15-17H2,2-3H3/b6-5+,10-8+,14-11+/t18-,19?,20-,21+/m0/s1",C=CC[C@@H](CC/C=C/C=C/CC/C=C/C1CSC([C@@H]2C[C@@H]2C)=N1)OC,C22H33NOS,,359.228285676,SSJXRCYFOOLEKV,Polyketides,Linear polyketides,Open-chain polyketides,Lyngbya polychroa,648243.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Lyngbya'],['Lyngbya polychroa'],0,0,1.0423208475112915 6085,2813,-1,,,,0.2605802,ISDB,SSJXRCYFOOLEKV-QRRFGNQQSA-N,"InChI=1S/C22H33NOS/c1-4-13-20(24-3)15-12-10-8-6-5-7-9-11-14-19-17-25-22(23-19)21-16-18(21)2/h4-6,8,10-11,14,18-21H,1,7,9,12-13,15-17H2,2-3H3/b6-5+,10-8+,14-11-/t18-,19-,20-,21+/m0/s1",C=CC[C@@H](CC/C=C/C=C/CC/C=C\[C@H]1CSC([C@@H]2C[C@@H]2C)=N1)OC,C22H33NOS,,359.228285676,SSJXRCYFOOLEKV,Polyketides,Linear polyketides,Open-chain polyketides,Lyngbya majuscula,588158.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Lyngbya'],['Lyngbya majuscula'],0,0,1.0423208475112915 6086,2813,-1,,,,0.2605802,ISDB,SSJXRCYFOOLEKV-NDGVNHDXSA-N,"InChI=1S/C22H33NOS/c1-4-13-20(24-3)15-12-10-8-6-5-7-9-11-14-19-17-25-22(23-19)21-16-18(21)2/h4-6,8,10-11,14,18-21H,1,7,9,12-13,15-17H2,2-3H3/b6-5+,10-8+,14-11-/t18-,19+,20-,21+/m0/s1",C=CC[C@@H](CC/C=C/C=C/CC/C=C\[C@@H]1CSC([C@@H]2C[C@@H]2C)=N1)OC,C22H33NOS,,359.228285676,SSJXRCYFOOLEKV,Polyketides,Linear polyketides,Open-chain polyketides,Symploca hydnoides,648240.0,['Bacteria'],['Unknown'],['Cyanobacteria'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Symploca'],['Symploca hydnoides'],0,0,1.0423208475112915 6087,2812,-1,,,,0.3533075,ISDB,,,,,,,IUTCUWWARLKNRX,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4132299423217773 6088,2810,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.4911087,ISDB,JOOCFKONPKMQIN-KEBDBYFISA-N,"InChI=1S/C29H34O4/c1-18(2)7-6-8-20(5)10-13-23-25-15-21(11-9-19(3)4)26(31)17-28(25)33-27-16-22(30)12-14-24(27)29(23)32/h7,9-10,12,14-17,30-32H,6,8,11,13H2,1-5H3/b20-10+",CC(C)=CCC/C(C)=C/CC1=C(O)c2ccc(O)cc2Oc2cc(O)c(CC=C(C)C)cc21,C29H34O4,,446.245709568,JOOCFKONPKMQIN,Shikimates and Phenylpropanoids,Stilbenoids,Monomeric stilbenes,Artocarpus rigidus,563906.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Artocarpus'],['Artocarpus rigidus'],4,0,5.964434742927551 6089,2805,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.27564725,ISDB,UNWCWBJEKCTIML-GKCIPKSASA-N,"InChI=1S/C22H24O8/c1-25-17-8-13(9-18(26-2)21(17)27-3)20(23)19-14(10-28-22(19)24)6-12-4-5-15-16(7-12)30-11-29-15/h4-5,7-9,14,19-20,23H,6,10-11H2,1-3H3/t14-,19-,20-/m0/s1",COc1cc([C@H](O)[C@H]2C(=O)OC[C@@H]2Cc2ccc3c(c2)OCO3)cc(OC)c1OC,C22H24O8,,416.14711772799984,UNWCWBJEKCTIML,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Condea verticillata,1062465.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Condea'],['Condea verticillata'],4,2,6.102589011192322 6090,2805,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.27564725,ISDB,UNWCWBJEKCTIML-GKCIPKSASA-N,"InChI=1S/C22H24O8/c1-25-17-8-13(9-18(26-2)21(17)27-3)20(23)19-14(10-28-22(19)24)6-12-4-5-15-16(7-12)30-11-29-15/h4-5,7-9,14,19-20,23H,6,10-11H2,1-3H3/t14-,19-,20-/m0/s1",COc1cc([C@H](O)[C@H]2C(=O)OC[C@@H]2Cc2ccc3c(c2)OCO3)cc(OC)c1OC,C22H24O8,,416.14711772799984,UNWCWBJEKCTIML,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Hernandia guianensis,373836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia guianensis'],4,2,6.102589011192322 6091,2805,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.27564725,ISDB,UNWCWBJEKCTIML-GKCIPKSASA-N,"InChI=1S/C22H24O8/c1-25-17-8-13(9-18(26-2)21(17)27-3)20(23)19-14(10-28-22(19)24)6-12-4-5-15-16(7-12)30-11-29-15/h4-5,7-9,14,19-20,23H,6,10-11H2,1-3H3/t14-,19-,20-/m0/s1",COc1cc([C@H](O)[C@H]2C(=O)OC[C@@H]2Cc2ccc3c(c2)OCO3)cc(OC)c1OC,C22H24O8,,416.14711772799984,UNWCWBJEKCTIML,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Hernandia ovigera,1072062.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia ovigera'],4,2,6.102589011192322 6092,2805,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.27564725,ISDB,UNWCWBJEKCTIML-GKCIPKSASA-N,"InChI=1S/C22H24O8/c1-25-17-8-13(9-18(26-2)21(17)27-3)20(23)19-14(10-28-22(19)24)6-12-4-5-15-16(7-12)30-11-29-15/h4-5,7-9,14,19-20,23H,6,10-11H2,1-3H3/t14-,19-,20-/m0/s1",COc1cc([C@H](O)[C@H]2C(=O)OC[C@@H]2Cc2ccc3c(c2)OCO3)cc(OC)c1OC,C22H24O8,,416.14711772799984,UNWCWBJEKCTIML,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Hernandia sonora,1035519.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia sonora'],4,2,6.102589011192322 6093,2805,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.27564725,ISDB,UNWCWBJEKCTIML-GKCIPKSASA-N,"InChI=1S/C22H24O8/c1-25-17-8-13(9-18(26-2)21(17)27-3)20(23)19-14(10-28-22(19)24)6-12-4-5-15-16(7-12)30-11-29-15/h4-5,7-9,14,19-20,23H,6,10-11H2,1-3H3/t14-,19-,20-/m0/s1",COc1cc([C@H](O)[C@H]2C(=O)OC[C@@H]2Cc2ccc3c(c2)OCO3)cc(OC)c1OC,C22H24O8,,416.14711772799984,UNWCWBJEKCTIML,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Hernandia nymphaeifolia,638626.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia nymphaeifolia'],4,2,6.102589011192322 6094,2805,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.27564725,ISDB,UNWCWBJEKCTIML-UHFFFAOYSA-N,"InChI=1S/C22H24O8/c1-25-17-8-13(9-18(26-2)21(17)27-3)20(23)19-14(10-28-22(19)24)6-12-4-5-15-16(7-12)30-11-29-15/h4-5,7-9,14,19-20,23H,6,10-11H2,1-3H3",COc1cc(C(O)C2C(=O)OCC2Cc2ccc3c(c2)OCO3)cc(OC)c1OC,C22H24O8,,416.147117728,UNWCWBJEKCTIML,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Podophyllum hexandrum,981662.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Sinopodophyllum'],['Sinopodophyllum hexandrum'],4,2,6.102589011192322 6095,2804,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.4902344,ISDB,JOOCFKONPKMQIN-KEBDBYFISA-N,"InChI=1S/C29H34O4/c1-18(2)7-6-8-20(5)10-13-23-25-15-21(11-9-19(3)4)26(31)17-28(25)33-27-16-22(30)12-14-24(27)29(23)32/h7,9-10,12,14-17,30-32H,6,8,11,13H2,1-5H3/b20-10+",CC(C)=CCC/C(C)=C/CC1=C(O)c2ccc(O)cc2Oc2cc(O)c(CC=C(C)C)cc21,C29H34O4,,446.245709568,JOOCFKONPKMQIN,Shikimates and Phenylpropanoids,Stilbenoids,Monomeric stilbenes,Artocarpus rigidus,563906.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Artocarpus'],['Artocarpus rigidus'],4,0,5.9609376192092896 6096,2802,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.52985704,ISDB,BYDQKMZEOZVIJM-ZGCJARKRSA-N,"InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,8-9H,7,10H2,1-4H3/b6-5-,12-9-",C/C=C\C=C1\C(C)=CCCC1(C)C,C13H20,,176.15650064,BYDQKMZEOZVIJM,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Passiflora edulis,183517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora edulis'],4,1,6.6194281578063965 6097,2798,-1,,,,0.0,MS1_match,XCGZLOPHNCJNRF-OXCLCMQMSA-N,"InChI=1S/C17H28O4/c1-9-6-13(19)15-11(9)7-12-14(20-10(2)18)8-17(15,5)21-16(12,3)4/h9,11-15,19H,6-8H2,1-5H3/t9-,11-,12+,13-,14+,15+,17+/m1/s1",CC(=O)O[C@H]1C[C@]2(C)OC(C)(C)[C@H]1C[C@H]1[C@H]2[C@H](O)C[C@H]1C,C17H28O4,pos_2MHNH3,296.198759376,XCGZLOPHNCJNRF,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6098,2798,-1,,,,0.0,MS1_match,XCGZLOPHNCJNRF-OXCLCMQMSA-N,"InChI=1S/C17H28O4/c1-9-6-13(19)15-11(9)7-12-14(20-10(2)18)8-17(15,5)21-16(12,3)4/h9,11-15,19H,6-8H2,1-5H3/t9-,11-,12+,13-,14+,15+,17+/m1/s1",CC(=O)O[C@H]1C[C@]2(C)OC(C)(C)[C@H]1C[C@H]1[C@H]2[C@H](O)C[C@H]1C,C17H28O4,pos_2MHNH3,296.198759376,XCGZLOPHNCJNRF,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 6099,2798,-1,,,,0.0,MS1_match,KSJYGLBFXLTFDO-VQOJOYJTSA-N,"InChI=1S/C17H28O4/c1-9-6-14(20-10(2)18)15-11(9)7-12-13(19)8-17(15,5)21-16(12,3)4/h9,11-15,19H,6-8H2,1-5H3/t9-,11-,12+,13+,14-,15+,17+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@H]2C[C@H]3[C@@H](O)C[C@](C)(OC3(C)C)[C@@H]21,C17H28O4,pos_2MHNH3,296.198759376,KSJYGLBFXLTFDO,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6100,2798,-1,,,,0.0,MS1_match,KSJYGLBFXLTFDO-VQOJOYJTSA-N,"InChI=1S/C17H28O4/c1-9-6-14(20-10(2)18)15-11(9)7-12-13(19)8-17(15,5)21-16(12,3)4/h9,11-15,19H,6-8H2,1-5H3/t9-,11-,12+,13+,14-,15+,17+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@H]2C[C@H]3[C@@H](O)C[C@](C)(OC3(C)C)[C@@H]21,C17H28O4,pos_2MHNH3,296.198759376,KSJYGLBFXLTFDO,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 6101,2797,-1,,,,0.2793909,ISDB,,,,,,,CHEGICVBARQRSP,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1175636053085327 6102,2796,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HNZUNIKWNYHEJJ-FMIVXFBMSA-N,"InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+",CC(=O)CC/C=C(\C)CCC=C(C)C,C13H22O,pos_1_1proton1methanol,194.167065324,HNZUNIKWNYHEJJ,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 6103,2795,-1,,,,0.59279305,ISDB,LJSWNKCFSXCFOR-KDVCKOBUSA-N,"InChI=1S/C27H41NO3/c1-15-11-23-24(28-14-15)16(2)27(31-23)10-8-20-19-6-5-17-12-18(29)7-9-25(17,3)21(19)13-22(20)26(27,4)30/h5,13,15-16,18-21,23-24,28-30H,6-12,14H2,1-4H3/t15-,16+,18-,19-,20-,21-,23+,24-,25-,26+,27+/m0/s1",C[C@@H]1CN[C@H]2[C@@H](C)[C@@]3(CC[C@@H]4C(=C[C@H]5[C@H]4CC=C4C[C@@H](O)CC[C@@]45C)[C@@]3(C)O)O[C@@H]2C1,C27H41NO3,,427.308644172,LJSWNKCFSXCFOR,Alkaloids,Pseudoalkaloids,Steroidal alkaloids,Veratrum nigrum,290488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Melanthiaceae'],['Unknown'],['Veratrum'],['Veratrum nigrum'],4,0,6.371172189712524 6104,2793,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RUVINXPYWBROJD-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3",CC=Cc1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6105,2788,-1,,,,0.73560566,ISDB,QFCXPIZNNLLXTL-ZPHSHJAVSA-N,"InChI=1S/C20H33NO2/c1-4-5-6-7-8-9-11-18-12-10-13-19-14-15-20(23-17(3)22)16(2)21(18)19/h7-9,11,16,18-20H,4-6,10,12-15H2,1-3H3/b8-7+,11-9+/t16-,18+,19-,20+/m0/s1",CCCC/C=C/C=C/[C@@H]1CCC[C@H]2CC[C@@H](OC(C)=O)[C@H](C)N21,C20H33NO2,,319.251129296,QFCXPIZNNLLXTL,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Clavelina picta,372937.0,['Eukaryota'],['Metazoa'],['Chordata'],['Ascidiacea'],['Enterogona'],['Clavelinidae'],['Unknown'],['Clavelina'],['Clavelina picta'],1,0,3.94242262840271 6106,2786,530,Amino acids and Peptides,Oligopeptides,Cyclic peptides,0.6567353,ISDB,NHNDCMROOPKDNF-BYZHJWIBSA-N,"InChI=1S/C30H44N6O7/c1-5-18(4)25-30(43)36-13-9-12-22(36)28(41)31-15-23(38)34-24(17(2)3)29(42)32-20(14-19-10-7-6-8-11-19)26(39)33-21(16-37)27(40)35-25/h6-8,10-11,17-18,20-22,24-25,37H,5,9,12-16H2,1-4H3,(H,31,41)(H,32,42)(H,33,39)(H,34,38)(H,35,40)/t18-,20-,21-,22-,24-,25-/m0/s1",CC[C@H](C)[C@@H]1NC(=O)[C@H](CO)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]2CCCN2C1=O,C30H44N6O7,,600.3271477479999,NHNDCMROOPKDNF,Amino acids and Peptides,Oligopeptides,Cyclic peptides,Dianthus longicalyx,904393.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus longicalyx'],4,3,8.126941204071045 6107,2786,530,Amino acids and Peptides,Oligopeptides,Cyclic peptides,0.6567353,ISDB,NHNDCMROOPKDNF-BYZHJWIBSA-N,"InChI=1S/C30H44N6O7/c1-5-18(4)25-30(43)36-13-9-12-22(36)28(41)31-15-23(38)34-24(17(2)3)29(42)32-20(14-19-10-7-6-8-11-19)26(39)33-21(16-37)27(40)35-25/h6-8,10-11,17-18,20-22,24-25,37H,5,9,12-16H2,1-4H3,(H,31,41)(H,32,42)(H,33,39)(H,34,38)(H,35,40)/t18-,20-,21-,22-,24-,25-/m0/s1",CC[C@H](C)[C@@H]1NC(=O)[C@H](CO)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]2CCCN2C1=O,C30H44N6O7,,600.3271477479999,NHNDCMROOPKDNF,Amino acids and Peptides,Oligopeptides,Cyclic peptides,Dianthus superbus,432192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus superbus'],4,3,8.126941204071045 6108,2784,-1,,,,0.7561455,ISDB,MLMCOAUMNMJPGN-UHFFFAOYSA-N,"InChI=1S/C28H35N3O4/c1-23(2)10-9-16-18(35-23)8-7-17-20(16)29-21(32)27(17)14-26-15-31-12-11-25(5,34)28(31,22(33)30(26)6)13-19(26)24(27,3)4/h7-10,19,34H,11-15H2,1-6H3,(H,29,32)",CN1C(=O)C23CC4C1(CN2CCC3(C)O)CC1(C(=O)Nc2c1ccc1c2C=CC(C)(C)O1)C4(C)C,C28H35N3O4,,477.2627566,MLMCOAUMNMJPGN,Alkaloids,Peptide alkaloids,"Indole diketopiperazine alkaloids (L-Trp, L-Pro)",Penicillium simplicissimum,968742.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium simplicissimum'],1,0,4.0245819091796875 6109,2784,-1,,,,0.7561455,ISDB,MLMCOAUMNMJPGN-UHFFFAOYSA-N,"InChI=1S/C28H35N3O4/c1-23(2)10-9-16-18(35-23)8-7-17-20(16)29-21(32)27(17)14-26-15-31-12-11-25(5,34)28(31,22(33)30(26)6)13-19(26)24(27,3)4/h7-10,19,34H,11-15H2,1-6H3,(H,29,32)",CN1C(=O)C23CC4C1(CN2CCC3(C)O)CC1(C(=O)Nc2c1ccc1c2C=CC(C)(C)O1)C4(C)C,C28H35N3O4,,477.2627566,MLMCOAUMNMJPGN,Alkaloids,Peptide alkaloids,"Indole diketopiperazine alkaloids (L-Trp, L-Pro)",Penicillium paraherquei,44030.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium paraherquei'],1,0,4.0245819091796875 6110,2784,-1,,,,0.7561455,ISDB,MLMCOAUMNMJPGN-UHFFFAOYSA-N,"InChI=1S/C28H35N3O4/c1-23(2)10-9-16-18(35-23)8-7-17-20(16)29-21(32)27(17)14-26-15-31-12-11-25(5,34)28(31,22(33)30(26)6)13-19(26)24(27,3)4/h7-10,19,34H,11-15H2,1-6H3,(H,29,32)",CN1C(=O)C23CC4C1(CN2CCC3(C)O)CC1(C(=O)Nc2c1ccc1c2C=CC(C)(C)O1)C4(C)C,C28H35N3O4,,477.2627566,MLMCOAUMNMJPGN,Alkaloids,Peptide alkaloids,"Indole diketopiperazine alkaloids (L-Trp, L-Pro)",Penicillium brasilianum,565072.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium brasilianum'],1,0,4.0245819091796875 6111,2784,-1,,,,0.7561455,ISDB,MLMCOAUMNMJPGN-WGNDVSEMSA-N,"InChI=1S/C28H35N3O4/c1-23(2)10-9-16-18(35-23)8-7-17-20(16)29-21(32)27(17)14-26-15-31-12-11-25(5,34)28(31,22(33)30(26)6)13-19(26)24(27,3)4/h7-10,19,34H,11-15H2,1-6H3,(H,29,32)/t19-,25+,26-,27+,28-/m0/s1",CN1C(=O)[C@]23C[C@H]4C(C)(C)[C@@]5(C[C@]41CN2CC[C@@]3(C)O)C(=O)Nc1c5ccc2c1C=CC(C)(C)O2,C28H35N3O4,,477.2627566,MLMCOAUMNMJPGN,Alkaloids,Peptide alkaloids,"Indole diketopiperazine alkaloids (L-Trp, L-Pro)",Penicillium dierckxii,424442.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium dierckxii'],1,0,4.0245819091796875 6112,2784,-1,,,,0.7561455,ISDB,MLMCOAUMNMJPGN-WGNDVSEMSA-N,"InChI=1S/C28H35N3O4/c1-23(2)10-9-16-18(35-23)8-7-17-20(16)29-21(32)27(17)14-26-15-31-12-11-25(5,34)28(31,22(33)30(26)6)13-19(26)24(27,3)4/h7-10,19,34H,11-15H2,1-6H3,(H,29,32)/t19-,25+,26-,27+,28-/m0/s1",CN1C(=O)[C@]23C[C@H]4C(C)(C)[C@@]5(C[C@]41CN2CC[C@@]3(C)O)C(=O)Nc1c5ccc2c1C=CC(C)(C)O2,C28H35N3O4,,477.2627566,MLMCOAUMNMJPGN,Alkaloids,Peptide alkaloids,"Indole diketopiperazine alkaloids (L-Trp, L-Pro)",Penicillium charlesii,448568.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium charlesii'],1,0,4.0245819091796875 6113,2783,1534,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MCHOUIJOPUPQRU-UHFFFAOYSA-N,"InChI=1S/C13H18O3/c1-8-2-3-9-6-11(9)7-10(13(15)16)4-5-12(8)14/h7,9,11-12,14H,1-6H2,(H,15,16)",C=C1CCC2CC2C=C(C(=O)O)CCC1O,C13H18O3,pos_1_1proton1methanol,222.125594436,MCHOUIJOPUPQRU,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,3,7.5 6114,2783,1534,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MCHOUIJOPUPQRU-UHFFFAOYSA-N,"InChI=1S/C13H18O3/c1-8-2-3-9-6-11(9)7-10(13(15)16)4-5-12(8)14/h7,9,11-12,14H,1-6H2,(H,15,16)",C=C1CCC2CC2C=C(C(=O)O)CCC1O,C13H18O3,pos_1_1proton1methanol,222.125594436,MCHOUIJOPUPQRU,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6115,2776,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.33310497,ISDB,QTUISSYYAYQHML-UFONIEFXSA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22+,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia hirsutula,278958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia hirsutula'],4,2,6.3324198722839355 6116,2776,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.33310497,ISDB,QTUISSYYAYQHML-UFONIEFXSA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22+,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia stricta,981039.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia stricta'],4,2,6.3324198722839355 6117,2776,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.33310497,ISDB,QTUISSYYAYQHML-ZQAWKMMESA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22-,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia squarrosa,912596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia squarrosa'],4,2,6.3324198722839355 6118,2776,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.33310497,ISDB,QTUISSYYAYQHML-ZQAWKMMESA-N,"InChI=1S/C24H38O5/c1-7-19(25)28-16-17-9-10-18-21(2,3)11-8-12-23(18,5)24(17)14-13-22(4,29-24)15-20(26)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,22-,23-,24+/m0/s1",CCC(=O)OCC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@@](C)(CC(=O)OC)O2,C24H38O5,,406.271924316,QTUISSYYAYQHML,Terpenoids,Diterpenoids,,Grindelia camporum,974633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia camporum'],4,2,6.3324198722839355 6119,2775,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.46755302,ISDB,HQPQTQQUHPFUOA-ZCPYHVQDSA-N,"InChI=1S/C27H36O2/c1-21(11-7-8-12-22(2)15-10-18-28)13-9-14-23(3)16-17-26-24(4)19-25(29)20-27(26,5)6/h7-18,25,29H,19-20H2,1-6H3/b8-7+,13-9+,15-10+,17-16+,21-11+,22-12+,23-14+/t25-/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=O)C(C)(C)C[C@H](O)C1,C27H36O2,,392.271530392,HQPQTQQUHPFUOA,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,1,6.370212078094482 6120,2772,644,,,,0.32334173,ISDB,,,,,,,BXFPGPRDNQSKKM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2933669090270996 6121,2771,-1,,,,0.0,MS1_match,FRBHXYYJMYBCSK-SECHYRITSA-N,"InChI=1S/C30H46O4/c1-18(2)19-9-14-30(25(33)34)16-15-28(5)20(24(19)30)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h19-22,24,31H,1,7-17H2,2-6H3,(H,33,34)/t19-,20+,21+,22+,24+,26-,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O4,pos_1_1proton,470.33960995199993,FRBHXYYJMYBCSK,Terpenoids,Triterpenoids,Lupane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,0,7.0 6122,2771,-1,,,,0.0,MS1_match,FRBHXYYJMYBCSK-SECHYRITSA-N,"InChI=1S/C30H46O4/c1-18(2)19-9-14-30(25(33)34)16-15-28(5)20(24(19)30)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h19-22,24,31H,1,7-17H2,2-6H3,(H,33,34)/t19-,20+,21+,22+,24+,26-,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O4,pos_1_1proton,470.33960995199993,FRBHXYYJMYBCSK,Terpenoids,Triterpenoids,Lupane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 6123,2771,-1,,,,0.0,MS1_match,WCXZTKJFWJFMJG-UHFFFAOYSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)",CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(CO)C5CCC43C)C2C1,C30H46O4,pos_1_1proton,470.339609952,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,0,7.0 6124,2771,-1,,,,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_1_1proton,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 6125,2771,-1,,,,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_1_1proton,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla dahurica,972663.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla dahurica'],7,0,7.0 6126,2771,-1,,,,0.0,MS1_match,WCXZTKJFWJFMJG-UHFFFAOYSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)",CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(CO)C5CCC43C)C2C1,C30H46O4,pos_1_1proton,470.339609952,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,0,7.0 6127,2771,-1,,,,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_1_1proton,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 6128,2771,-1,,,,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_1_1proton,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla dahurica,972663.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla dahurica'],7,0,7.0 6129,2769,907,Fatty acids,Sphingolipids,Phytane diterpenoids,0.6686419,ISDB,IRJHFRKRPYTYCQ-UAYKKUFWSA-N,"InChI=1S/C25H50O/c1-21(2)11-7-12-22(3)13-8-14-23(4)15-9-16-24(5)17-10-18-25(6)19-20-26/h19,21-24,26H,7-18,20H2,1-6H3/b25-19-/t22-,23-,24-/m1/s1",C/C(=C/CO)CCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C,C25H50O,,366.38616622,IRJHFRKRPYTYCQ,Terpenoids,Diterpenoids,Phytane diterpenoids,Croton hieronymi,3913472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton hieronymi'],4,3,8.174567699432373 6130,2768,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.50825274,ISDB,SDLRNDWZNXRCGY-OHLCYODYSA-N,"InChI=1S/C25H34O3/c1-15-6-9-20-23(2,3)10-5-11-24(20,4)19(15)14-25-21(27)12-16-7-8-17(26)13-18(16)22(25)28-25/h6,12-13,19-22,27H,5,7-11,14H2,1-4H3/t19-,20-,21+,22+,24+,25-/m0/s1",CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@@]12O[C@@H]1C1=CC(=O)CCC1=C[C@H]2O,C25H34O3,,382.250794948,SDLRNDWZNXRCGY,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,Didymella coffeae-arabicae,98629.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Didymellaceae'],['Unknown'],['Phoma'],['Peyronellaea coffeae-arabicae'],0,1,2.533010959625244 6131,2767,92,Polyketides,Phenylpropanoids (C6-C3),Macrolide lactones,0.43464485,ISDB,ZZDJNPFVWSOKTO-TULNHCNLSA-N,"InChI=1S/C24H26O10/c1-13(25)15-6-9-17(18(11-15)31-2)33-24-23(30)22(29)21(28)19(34-24)12-32-20(27)10-5-14-3-7-16(26)8-4-14/h3-11,19,21-24,26,28-30H,12H2,1-2H3/b10-5+/t19-,21-,22+,23-,24-/m1/s1",COc1cc(C(C)=O)ccc1O[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O,C24H26O10,,474.1525970319999,ZZDJNPFVWSOKTO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Picrorhiza scrophulariiflora,257215.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Veroniceae'],['Neopicrorhiza'],['Neopicrorhiza scrophulariiflora'],4,2,6.7385793924331665 6132,2767,92,Polyketides,Phenylpropanoids (C6-C3),Macrolide lactones,0.43464485,ISDB,ZZDJNPFVWSOKTO-FTFWDOSHSA-N,"InChI=1S/C24H26O10/c1-13(25)15-6-9-17(18(11-15)31-2)33-24-23(30)22(29)21(28)19(34-24)12-32-20(27)10-5-14-3-7-16(26)8-4-14/h3-11,19,21-24,26,28-30H,12H2,1-2H3/b10-5+/t19-,21+,22+,23-,24-/m1/s1",COc1cc(C(C)=O)ccc1O[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O,C24H26O10,,474.152597032,ZZDJNPFVWSOKTO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Neopicrorhiza scrophulariiflora,257215.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Veroniceae'],['Neopicrorhiza'],['Neopicrorhiza scrophulariiflora'],4,2,6.7385793924331665 6133,2764,-1,,,,0.0,MS1_match,ACAYJUFAIJJELS-SDQBBNPISA-N,"InChI=1S/C14H15NO2/c1-9(2)4-6-12-11-7-5-10(17-3)8-13(11)15-14(12)16/h4-8H,1-3H3,(H,15,16)/b12-6-",COc1ccc2c(c1)NC(=O)/C2=C\C=C(C)C,C14H15NO2,pos_2_2proton1acetonitrile,229.11027872,ACAYJUFAIJJELS,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,Actaea vaginata,512706.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea vaginata'],6,0,6.0 6134,2763,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,HYPGAWDRWVQHEX-UHFFFAOYSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(15(22)23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2",O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)OC(CO)C(O)C1O,C15H18O9,pos_1_1proton1acetonitrile,342.095082156,HYPGAWDRWVQHEX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 6135,2763,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,HYPGAWDRWVQHEX-UHFFFAOYSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(15(22)23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2",O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)OC(CO)C(O)C1O,C15H18O9,pos_1_1proton1acetonitrile,342.095082156,HYPGAWDRWVQHEX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 6136,2760,-1,,,,0.29260027,ISDB,QQHJDPROMQRDLA-UHFFFAOYSA-N,"InChI=1S/C16H30O4/c17-15(18)13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)20/h1-14H2,(H,17,18)(H,19,20)",O=C(O)CCCCCCCCCCCCCCC(=O)O,C16H30O4,,286.21440944,QQHJDPROMQRDLA,Fatty acids,Fatty Acids and Conjugates,Dicarboxylic acids,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,0,5.170401096343994 6137,2760,-1,,,,0.29260027,ISDB,QQHJDPROMQRDLA-UHFFFAOYSA-N,"InChI=1S/C16H30O4/c17-15(18)13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)20/h1-14H2,(H,17,18)(H,19,20)",O=C(O)CCCCCCCCCCCCCCC(=O)O,C16H30O4,,286.21440944,QQHJDPROMQRDLA,Fatty acids,Fatty Acids and Conjugates,Dicarboxylic acids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,5.170401096343994 6138,2757,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.31207085,ISDB,JDKUSIUPEUOZEW-MUFKJQONSA-N,"InChI=1S/C24H38O6/c1-16(11-13-25)10-12-23(3)18(15-30-22(29)9-8-21(27)28)19(26)14-24(4)17(2)6-5-7-20(23)24/h6,11,18-20,25-26H,5,7-10,12-15H2,1-4H3,(H,27,28)/b16-11+/t18-,19+,20-,23+,24+/m1/s1",CC1=CCC[C@@H]2[C@@](C)(CC/C(C)=C/CO)[C@H](COC(=O)CCC(=O)O)[C@@H](O)C[C@@]12C,C24H38O6,,422.266838936,JDKUSIUPEUOZEW,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Baccharis pteronioides,3898913.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Baccharis'],['Baccharis pteronioides'],4,2,6.248283386230469 6139,2755,941,Terpenoids,Steroids,Cholestane steroids,0.21273698,ISDB,WADMTJKRYLAHQV-GYVNTCMOSA-N,"InChI=1S/C29H50O5/c1-7-17(15(2)3)27(34)26(33)16(4)19-8-9-20-18-12-23(30)22-13-24(31)25(32)14-29(22,6)21(18)10-11-28(19,20)5/h15-22,24-27,31-34H,7-14H2,1-6H3/t16-,17-,18-,19+,20-,21-,22+,24-,25+,26+,27+,28-,29+/m0/s1",CC[C@@H](C(C)C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C29H50O5,,478.3658247,WADMTJKRYLAHQV,Terpenoids,Steroids,Cholestane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,6.350947916507721 6140,2755,941,Terpenoids,Steroids,Cholestane steroids,0.21273698,ISDB,WADMTJKRYLAHQV-GYVNTCMOSA-N,"InChI=1S/C29H50O5/c1-7-17(15(2)3)27(34)26(33)16(4)19-8-9-20-18-12-23(30)22-13-24(31)25(32)14-29(22,6)21(18)10-11-28(19,20)5/h15-22,24-27,31-34H,7-14H2,1-6H3/t16-,17-,18-,19+,20-,21-,22+,24-,25+,26+,27+,28-,29+/m0/s1",CC[C@@H](C(C)C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C29H50O5,,478.3658247,WADMTJKRYLAHQV,Terpenoids,Steroids,Cholestane steroids,Oryza sativa,709894.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Oryzeae'],['Oryza'],['Oryza sativa'],4,3,6.350947916507721 6141,2755,941,Terpenoids,Steroids,Cholestane steroids,0.21273698,ISDB,WADMTJKRYLAHQV-GYVNTCMOSA-N,"InChI=1S/C29H50O5/c1-7-17(15(2)3)27(34)26(33)16(4)19-8-9-20-18-12-23(30)22-13-24(31)25(32)14-29(22,6)21(18)10-11-28(19,20)5/h15-22,24-27,31-34H,7-14H2,1-6H3/t16-,17-,18-,19+,20-,21-,22+,24-,25+,26+,27+,28-,29+/m0/s1",CC[C@@H](C(C)C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C29H50O5,,478.3658247,WADMTJKRYLAHQV,Terpenoids,Steroids,Cholestane steroids,Vicia faba,539544.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Vicia'],['Vicia faba'],4,3,6.350947916507721 6142,2755,941,Terpenoids,Steroids,Cholestane steroids,0.21273698,ISDB,WADMTJKRYLAHQV-NKOPCKDMSA-N,"InChI=1S/C29H50O5/c1-7-17(15(2)3)27(34)26(33)16(4)19-8-9-20-18-12-23(30)22-13-24(31)25(32)14-29(22,6)21(18)10-11-28(19,20)5/h15-22,24-27,31-34H,7-14H2,1-6H3/t16-,17-,18-,19+,20-,21-,22+,24-,25+,26+,27+,28+,29+/m0/s1",CC[C@@H](C(C)C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C29H50O5,,478.3658247,WADMTJKRYLAHQV,Terpenoids,Steroids,Cholestane steroids,Secale cereale,553015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Secale'],['Secale cereale'],4,3,6.350947916507721 6143,2750,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.25803614,ISDB,ZWXNTVDOCZMZEJ-XTCLZLMSSA-N,"InChI=1S/C34H62O9/c1-7-8-9-10-11-12-13-14-15-19-28(36)20-17-16-18-24(2)21-25(3)22-26(4)30(37)27(5)33(40)43-29(23-35)31(38)32(39)34(41)42-6/h22,24-25,27-29,31-32,35-36,38-39H,7-21,23H2,1-6H3/b26-22+",CCCCCCCCCCCC(O)CCCCC(C)CC(C)/C=C(\C)C(=O)C(C)C(=O)OC(CO)C(O)C(O)C(=O)OC,C34H62O9,,614.439383564,ZWXNTVDOCZMZEJ,Polyketides,Linear polyketides,Open-chain polyketides,Lauriomyces bellulus,960163.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Leotiomycetes'],['Helotiales'],['Unknown'],['Unknown'],['Lauriomyces'],['Lauriomyces bellulus'],1,0,2.032144546508789 6144,2749,-1,,,,0.2655064,ISDB,,,,,,,CYXKJSCQPMYPIV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.062025547027588 6145,2747,-1,,,,0.0,MS1_match,IPCSVZSSVZVIGE-UHFFFAOYSA-N,"InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)",CCCCCCCCCCCCCCCC(=O)O,C16H32O2,pos_2MH,256.240230264,IPCSVZSSVZVIGE,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 6146,2747,-1,,,,0.0,MS1_match,IPCSVZSSVZVIGE-UHFFFAOYSA-N,"InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)",CCCCCCCCCCCCCCCC(=O)O,C16H32O2,pos_2MH,256.240230264,IPCSVZSSVZVIGE,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,0,6.0 6147,2747,-1,,,,0.0,MS1_match,IPCSVZSSVZVIGE-UHFFFAOYSA-N,"InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)",CCCCCCCCCCCCCCCC(=O)O,C16H32O2,pos_2MH,256.240230264,IPCSVZSSVZVIGE,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6148,2747,-1,,,,0.0,MS1_match,IPCSVZSSVZVIGE-UHFFFAOYSA-N,"InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)",CCCCCCCCCCCCCCCC(=O)O,C16H32O2,pos_2MH,256.240230264,IPCSVZSSVZVIGE,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 6149,2746,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5313104,ISDB,CMXCLTFHXRTSPB-WIXFNSMHSA-N,"InChI=1S/C30H44O2/c1-18(2)9-7-10-19(3)23-14-22-16-30(25(23)13-21(22)5)26-15-24-20(4)11-8-12-29(24,6)17-27(26)32-28(30)31/h9,13,15,19-20,22-23,25-27H,7-8,10-12,14,16-17H2,1-6H3/t19-,20-,22+,23-,25-,26-,27+,29+,30-/m0/s1",CC(C)=CCC[C@H](C)[C@@H]1C[C@@H]2C[C@]3(C(=O)O[C@@H]4C[C@@]5(C)CCC[C@H](C)C5=C[C@@H]43)[C@H]1C=C2C,C30H44O2,,436.334130648,CMXCLTFHXRTSPB,Terpenoids,Triterpenoids,"Lanostane, Tirucallane and Euphane triterpenoids",Helenium autumnale,483908.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Helenium'],['Helenium autumnale'],4,2,7.12524151802063 6150,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 6151,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 6152,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 6153,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 6154,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-MDZDMXLPSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9+",CCCCCCCC/C=C/CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,3,7.5 6155,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-MDZDMXLPSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9+",CCCCCCCC/C=C/CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,7.5 6156,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Ranunculus glacialis,225728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus glacialis'],6,3,7.5 6157,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,3,7.5 6158,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,CNVZJPUDSLNTQU-SEYXRHQNSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h12-13H,2-11,14-17H2,1H3,(H,19,20)/b13-12-",CCCCCCCCCCC/C=C\CCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,CNVZJPUDSLNTQU,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 6159,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,CNVZJPUDSLNTQU-SEYXRHQNSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h12-13H,2-11,14-17H2,1H3,(H,19,20)/b13-12-",CCCCCCCCCCC/C=C\CCCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,CNVZJPUDSLNTQU,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 6160,2745,1697,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,AQWHMKSIVLSRNY-BUHFOSPRSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h13-14H,2-12,15-17H2,1H3,(H,19,20)/b14-13+",CCCCCCCCCCCC/C=C/CCCC(=O)O,C18H34O2,pos_1_1proton2acetonitrile,282.255880328,AQWHMKSIVLSRNY,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,3,7.5 6161,2743,241,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,RRBKPDNMJPPISI-CONSDPRKSA-N,"InChI=1S/C38H44N2O7/c1-39-15-13-25-20-34(44-4)32(41)21-28(25)30(39)18-24-9-12-33(43-3)35(19-24)47-26-10-7-23(8-11-26)17-31-29-22-36(45-5)38(46-6)37(42)27(29)14-16-40(31)2/h7-12,19-22,30-31,41-42H,13-18H2,1-6H3/t30-,31-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)c(O)c5CCN4C)cc3)c1)N(C)CC2,C38H44N2O7,pos_2_1proton1sodium,640.314851748,RRBKPDNMJPPISI,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 6162,2743,241,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,RRBKPDNMJPPISI-CONSDPRKSA-N,"InChI=1S/C38H44N2O7/c1-39-15-13-25-20-34(44-4)32(41)21-28(25)30(39)18-24-9-12-33(43-3)35(19-24)47-26-10-7-23(8-11-26)17-31-29-22-36(45-5)38(46-6)37(42)27(29)14-16-40(31)2/h7-12,19-22,30-31,41-42H,13-18H2,1-6H3/t30-,31-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)c(O)c5CCN4C)cc3)c1)N(C)CC2,C38H44N2O7,pos_2_1proton1sodium,640.314851748,RRBKPDNMJPPISI,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum cultratum,583170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum cultratum'],6,3,7.5 6163,2742,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.42561868,ISDB,UPFYDFUDOLTMGS-JXIJRUCRSA-N,"InChI=1S/C19H30O9/c1-9-7-11(21)16(25)18(3,4)19(9,26)6-5-10(2)27-17-15(24)14(23)13(22)12(8-20)28-17/h5-7,10,12-17,20,22-26H,8H2,1-4H3/b6-5+/t10-,12+,13+,14-,15+,16-,17+,19+/m0/s1",CC1=CC(=O)[C@H](O)C(C)(C)[C@@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H30O9,,402.18898254,UPFYDFUDOLTMGS,Terpenoids,Apocarotenoids,Megastigmanes,Sauropus androgynus,855617.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Sauropus'],['Sauropus androgynus'],4,2,6.7024747133255005 6164,2739,312,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.3143628,ISDB,IBGZNOPZUVZSEJ-XSVWGIRKSA-N,"InChI=1S/C20H27NO11/c22-6-11-13(23)15(25)17(27)19(31-11)29-7-12-14(24)16(26)18(28)20(32-12)30-10-5-21-9-4-2-1-3-8(9)10/h1-5,11-28H,6-7H2/t11-,12-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1",OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c[nH]c4ccccc34)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C20H27NO11,,457.158410684,IBGZNOPZUVZSEJ,,,,Calanthe discolor,809338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Collabieae'],['Calanthe'],['Calanthe discolor'],4,0,5.257451176643372 6165,2735,863,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,0.47042754,ISDB,HZOHTLMLLIVQEA-ODYMNIRHSA-N,"InChI=1S/C19H21NO5/c1-23-12-5-4-11-6-18(22)20-10-15(21)13-7-16(24-2)17(25-3)8-14(13)19(11,20)9-12/h4-8,12,15,21H,9-10H2,1-3H3/t12-,15-,19-/m0/s1",COc1cc2c(cc1OC)[C@]13C[C@@H](OC)C=CC1=CC(=O)N3C[C@@H]2O,C19H21NO5,,343.141972772,HZOHTLMLLIVQEA,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Erythrina lysistemon,284184.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Erythrina'],['Erythrina lysistemon'],0,3,3.381710171699524 6166,2728,294,Polyketides,Cyclic polyketides,Cinnamic acids and derivatives,0.0,MS1_match,RUVINXPYWBROJD-ONEGZZNKSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+",C/C=C/c1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 6167,2728,294,Polyketides,Cyclic polyketides,Cinnamic acids and derivatives,0.0,MS1_match,ZFMSMUAANRJZFM-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3",C=CCc1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,ZFMSMUAANRJZFM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 6168,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-RMKGEEGASA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19+,20-,22-,23+,24-,27+,28+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.2162599079999,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Sinoadina racemosa,1089075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Sinoadina'],['Sinoadina racemosa'],4,1,5.485155463218689 6169,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-LQDMBTRHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14-,18-,19-,20+,22+,23-,24+,27-,28-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Uncaria tomentosa,204985.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Uncaria'],['Uncaria tomentosa'],4,1,5.485155463218689 6170,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-BZAIPKEHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14-,18-,19+,20-,22-,23+,24-,27+,28+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@@H]1C[C@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Psychotria bahiensis,180165.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Psychotrieae'],['Psychotria'],['Psychotria bahiensis'],4,1,5.485155463218689 6171,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-UHFFFAOYSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1NC(C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Simira tinctoria,658663.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Condamineeae'],['Simira'],['Simira tinctoria'],4,1,5.485155463218689 6172,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-AZAOCEFRSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19+,20+,22+,23-,24+,27+,28-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.2162599079999,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Simira rubescens,389648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Condamineeae'],['Simira'],['Simira rubescens'],4,1,5.485155463218689 6173,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-BUZHDDSHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19-,20+,22+,23-,24+,27+,28-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Chimarrhis turbinata,327026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Condamineeae'],['Chimarrhis'],['Chimarrhis turbinata'],4,1,5.485155463218689 6174,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-AZAOCEFRSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19+,20+,22+,23-,24+,27+,28-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.2162599079999,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Stenostomum acreanum,155313.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Guettardeae'],['Stenostomum'],['Stenostomum acreanum'],4,1,5.485155463218689 6175,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-UHFFFAOYSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1NC(C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Rhazya stricta,618442.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Amsonieae'],['Rhazya'],['Rhazya stricta'],4,1,5.485155463218689 6176,2727,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-BZAIPKEHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14-,18-,19+,20-,22-,23+,24-,27+,28+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@@H]1C[C@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Amsonia orientalis,15769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Amsonieae'],['Amsonia'],['Amsonia orientalis'],4,1,5.485155463218689 6177,2726,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.60461825,ISDB,FKPBTDMCIDWKNL-VAHIBMBZSA-N,"InChI=1S/C37H40N4O5/c1-9-21-17(4)24-14-26-19(6)23(12-13-30(42)46-11-3)34(40-26)32-33(37(44)45-8)36(43)31-20(7)27(41-35(31)32)16-29-22(10-2)18(5)25(39-29)15-28(21)38-24/h9,14-16,19,23,33,40,43H,1,10-13H2,2-8H3/t19-,23-,33+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OCC)C4=N3)C(CC)=C1C,C37H40N4O5,,620.29987038,FKPBTDMCIDWKNL,Alkaloids,,,Neptunia prostrata,8611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Mimoseae'],['Neptunia'],['Neptunia oleracea'],4,0,6.4184730052948 6178,2726,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.60461825,ISDB,FKPBTDMCIDWKNL-VAHIBMBZSA-N,"InChI=1S/C37H40N4O5/c1-9-21-17(4)24-14-26-19(6)23(12-13-30(42)46-11-3)34(40-26)32-33(37(44)45-8)36(43)31-20(7)27(41-35(31)32)16-29-22(10-2)18(5)25(39-29)15-28(21)38-24/h9,14-16,19,23,33,40,43H,1,10-13H2,2-8H3/t19-,23-,33+/m0/s1",C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)[C@H](C(=O)OC)C(=C5NC(=C2)[C@@H](C)[C@@H]5CCC(=O)OCC)C4=N3)C(CC)=C1C,C37H40N4O5,,620.29987038,FKPBTDMCIDWKNL,Alkaloids,,,Neptunia oleracea,8611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Mimoseae'],['Neptunia'],['Neptunia oleracea'],4,0,6.4184730052948 6179,2724,462,Terpenoids,Steroids,Cholestane steroids,0.27321735,ISDB,HGCLEPLEUUJGID-REBIDWDSSA-N,"InChI=1S/C27H44O3/c1-17(2)7-6-8-18(3)20-9-10-21-22-16-24(29)23-15-19(28)11-12-26(23,5)27(22,30)14-13-25(20,21)4/h16-21,23,28,30H,6-15H2,1-5H3/t18-,19+,20-,21+,23-,25-,26+,27-/m1/s1",CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@@]3(O)CC[C@]12C,C27H44O3,,416.329045268,HGCLEPLEUUJGID,Terpenoids,Steroids,Cholestane steroids,Peniocereus viperinus,700179.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Cactaceae'],['Echinocereeae'],['Peniocereus'],['Peniocereus viperinus'],4,3,6.592869400978088 6180,2722,-1,,,,0.22450656,ISDB,,,,,,,PGVRRDBKGGPNGV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8980262279510498 6181,2711,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,DAUAQNGYDSHRET-UHFFFAOYSA-N,"InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)",COc1ccc(C(=O)O)cc1OC,C9H10O4,pos_2MHNH3,182.0579088,DAUAQNGYDSHRET,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,3,7.5 6182,2709,1044,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,UTNHBQHELZUVMJ-GFFQCQNISA-N,"InChI=1S/C19H34O8/c1-10-6-12(7-19(2,3)13(10)5-4-11(22)8-20)26-18-17(25)16(24)15(23)14(9-21)27-18/h4-5,10-18,20-25H,6-9H2,1-3H3/b5-4+/t10-,11-,12+,13+,14-,15-,16+,17-,18-/m1/s1",C[C@@H]1C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@H]1/C=C/[C@@H](O)CO,C19H34O8,pos_1_1proton1acetonitrile,390.22536804799984,UTNHBQHELZUVMJ,Terpenoids,Apocarotenoids,Megastigmanes,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,3,7.5 6183,2708,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,HPJJCRNQEWRFQW-ILXVDBEPSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(14(22)9-18)27-15(23)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-22,25H,2,8-9H2,1H3/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,HPJJCRNQEWRFQW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6184,2708,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CPYDMLXRLHYXSV-UNKAVFLYSA-N,"InChI=1S/C18H22O9/c1-25-13-7-10(3-5-11(13)19)4-6-15(21)27-14-9-18(24,17(23)26-2)8-12(20)16(14)22/h3-7,12,14,16,19-20,22,24H,8-9H2,1-2H3/b6-4+/t12-,14-,16-,18+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(OC)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,CPYDMLXRLHYXSV,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6185,2708,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6186,2708,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6187,2707,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,UEEFSWPSRLSUQJ-NOMYRAODSA-N,"InChI=1S/C25H31NO11/c1-2-15-16(8-7-14-5-3-9-26(11-14)10-4-6-19(28)29)17(23(33)34)13-35-24(15)37-25-22(32)21(31)20(30)18(12-27)36-25/h2-3,5,7-9,11,13,15-16,18,20-22,24-25,27,30-32H,1,4,6,10,12H2,(H-,28,29,33,34)/b8-7+/t15-,16+,18-,20-,21+,22-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCCC(=O)O)c1,C25H31NO11,pos_1_1proton1methanol,521.1897108119997,UEEFSWPSRLSUQJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 6188,2707,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QGCICTMJHHIGBT-LSWTWQANSA-N,"InChI=1S/C25H31NO11/c1-4-15-16(7-6-13-8-14(22(31)32)10-26(5-2)9-13)17(23(33)34-3)12-35-24(15)37-25-21(30)20(29)19(28)18(11-27)36-25/h4,6-10,12,15-16,18-21,24-25,27-30H,1,5,11H2,2-3H3/b7-6+/t15-,16+,18-,19-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)[O-])c[n+](CC)c1,C25H31NO11,pos_1_1proton1methanol,521.1897108119998,QGCICTMJHHIGBT,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 6189,2704,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.6521093,ISDB,YVJONNCAHSDDLZ-WEVVVXLNSA-N,"InChI=1S/C18H19NO4/c1-23-17-8-4-14(12-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+",COc1ccc(/C=C/C(=O)NCCc2ccc(O)cc2)cc1O,C18H19NO4,,313.131408088,YVJONNCAHSDDLZ,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Lycium chinense,58730.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Lycieae'],['Lycium'],['Lycium chinense'],4,3,8.108437299728394 6190,2702,-1,,,,0.28418332,ISDB,,,,,,,KZXDVJJOMQYNRC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1367332935333252 6191,2700,1176,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,0.0,MS1_match,GUZAIURHRDPBKE-HIEJAJBWSA-N,"InChI=1S/C30H46O3/c1-17(2)18-9-12-22-29(18,7)25(33)16-28(6)19-10-11-21-26(3,4)23(31)13-14-27(21,5)20(19)15-24(32)30(22,28)8/h10,15,17-18,21-23,25,31,33H,9,11-14,16H2,1-8H3/t18-,21+,22-,23-,25-,27-,28-,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC(=O)[C@@]21C,C30H46O3,pos_1_1proton,454.344695332,GUZAIURHRDPBKE,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 6192,2699,432,Terpenoids,Sesquiterpenoids,Menthane monoterpenoids,0.424196,ISDB,DGDRPKUDABZVDM-UHFFFAOYSA-N,"InChI=1S/C13H18O3/c1-8(2)11-7-12(15-5)9(3)6-13(11)16-10(4)14/h6-8H,1-5H3",COc1cc(C(C)C)c(OC(C)=O)cc1C,C13H18O3,,222.125594436,DGDRPKUDABZVDM,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Baccharis dracunculifolia,482153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Baccharis'],['Baccharis dracunculifolia'],0,3,3.196784019470215 6193,2693,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JLFVPRCFSAWIRQ-XYGBCAHESA-N,"InChI=1S/C35H55ClO8/c1-17-14-19-26(30(4,5)36)44-35(43-19)25(17)31(6)12-13-34-16-33(34)11-10-22(42-27-24(39)23(38)18(37)15-41-27)29(2,3)20(33)8-9-21(34)32(31,7)28(35)40/h17-28,37-40H,8-16H2,1-7H3/t17-,18-,19-,20+,21+,22+,23+,24-,25-,26+,27+,28-,31-,32-,33-,34+,35+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)Cl)[C@H](O)[C@@]2(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C35H55ClO8,pos_2_2proton,638.3585464,JLFVPRCFSAWIRQ,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,1,6.5 6194,2690,573,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-PXKJKYEHSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22+,23-,25-,26-,27+/m0/s1",CC(=O)OC[C@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_2_2proton2acetonitrile,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6195,2690,573,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-UHFFFAOYSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3",CC(=O)OCC1(O)C(O)CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C21,C27H42O12,pos_2_2proton2acetonitrile,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 6196,2690,573,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LUDMVJVLHCEECS-HXTWUXIJSA-N,"InChI=1S/C27H42O12/c1-14(2)8-20(30)38-22(16(5)6)24(32)35-11-18-12-36-25(39-21(31)9-15(3)4)23-26(18,33)10-19(29)27(23,34)13-37-17(7)28/h12,14-16,19,22-23,25,29,33-34H,8-11,13H2,1-7H3/t19-,22-,23-,25-,26-,27-/m0/s1",CC(=O)OC[C@@]1(O)[C@H]2[C@H](OC(=O)CC(C)C)OC=C(COC(=O)[C@@H](OC(=O)CC(C)C)C(C)C)[C@@]2(O)C[C@@H]1O,C27H42O12,pos_2_2proton2acetonitrile,558.267626784,LUDMVJVLHCEECS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6197,2684,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.33829197,ISDB,RSCFPLPQZJYJJX-BEBSALIASA-N,"InChI=1S/C30H40O10/c1-10-13(2)26(35)38-22-20-23(27(20,8)9)30(39-18(7)33)15(4)24(34)28-11-14(3)25(37-17(6)32)29(28,40-28)12-19(30)21(22)36-16(5)31/h12-15,20-23,25H,10-11H2,1-9H3/t13?,14?,15-,20?,21-,22-,23?,25+,28+,29+,30+/m1/s1",CCC(C)C(=O)O[C@@H]1C2C(C2(C)C)[C@@]2(OC(C)=O)C(=C[C@@]34O[C@@]3(CC(C)[C@@H]4OC(C)=O)C(=O)[C@H]2C)[C@H]1OC(C)=O,C30H40O10,,560.26214748,RSCFPLPQZJYJJX,Terpenoids,Diterpenoids,Lathyrane diterpenoids,Euphorbia royleana,734807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Euphorbieae'],['Euphorbia'],['Euphorbia royleana'],4,2,6.35316789150238 6198,2682,-1,,,,0.0,MS1_match,NNJLQFGHDVXBQL-UHFFFAOYSA-N,"InChI=1S/C38H52N2O10/c1-6-14-39-18-35(19-50-33(44)21-10-8-9-11-24(21)40-27(41)15-20(7-2)32(40)43)13-12-26(48-4)37-23-16-22-25(47-3)17-36(45,28(23)29(22)42)38(46,34(37)39)31(49-5)30(35)37/h8-11,20,22-23,25-26,28-31,34,42,45-46H,6-7,12-19H2,1-5H3",CCCN1CC2(COC(=O)c3ccccc3N3C(=O)CC(CC)C3=O)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C38H52N2O10,pos_2_2proton2acetonitrile,696.362195864,NNJLQFGHDVXBQL,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 6199,2681,-1,,,,0.0,MS1_match,HSUIVCLOAAJSRE-UHFFFAOYSA-N,"InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3",COCCOC(=O)c1ccccc1C(=O)OCCOC,C14H18O6,pos_2MHNH3,282.110338296,HSUIVCLOAAJSRE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6200,2681,-1,,,,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1acetonitrile,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 6201,2681,-1,,,,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1acetonitrile,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 6202,2681,-1,,,,0.0,MS1_match,VHHJRIJKJTYYIZ-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-10-14(4-3-9-27)5-7-16(18)36-20(12-28)22(30)15-6-8-17(19(11-15)35-2)37-26-25(33)24(32)23(31)21(13-29)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C26H36O12,pos_1_1proton1acetonitrile,540.220676592,VHHJRIJKJTYYIZ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 6203,2681,-1,,,,0.0,MS1_match,HZYWTYSKPVTFNA-URGBZLTBSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)30)25(38-26-24(33)23(32)22(31)20(12-28)37-26)21(13-29)36-17-8-5-14(4-3-9-27)10-19(17)35-2/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21+,22-,23+,24-,25+,26+/m1/s1",COc1cc([C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O,C26H36O12,pos_1_1proton1acetonitrile,540.220676592,HZYWTYSKPVTFNA,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 6204,2680,-1,,,,0.0,MS1_match,GHKISGDRQRSCII-ZOCIIQOWSA-N,"InChI=1S/C20H19NO5/c1-21-7-13-11(2-3-15-20(13)26-9-23-15)18-14(22)4-10-5-16-17(25-8-24-16)6-12(10)19(18)21/h2-3,5-6,14,18-19,22H,4,7-9H2,1H3/t14-,18-,19+/m0/s1",CN1Cc2c(ccc3c2OCO3)[C@@H]2[C@H]1c1cc3c(cc1C[C@@H]2O)OCO3,C20H19NO5,pos_1_1proton1methanol,353.126322708,GHKISGDRQRSCII,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 6205,2678,-1,,,,0.30135122,ISDB,ACQJQRDRWQGINF-VWKKOVPFSA-N,"InChI=1S/C30H52O5/c1-22(14-11-15-23(2)16-17-26(32)28(4,5)33)12-9-10-13-24(3)20-25(31)21-30(8)19-18-27(35-30)29(6,7)34/h12,15,20,26-27,32-34H,9-11,13-14,16-19,21H2,1-8H3/b22-12?,23-15+,24-20+/t26?,27-,30+/m0/s1",CC(=CCCC/C(C)=C/C(=O)C[C@@]1(C)CC[C@@H](C(C)(C)O)O1)CC/C=C(\C)CCC(O)C(C)(C)O,C30H52O5,,492.381474764,ACQJQRDRWQGINF,Terpenoids,Triterpenoids,Acyclic triterpenoids,Silphium laciniatum,464944.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Silphium'],['Silphium laciniatum'],4,0,5.205404877662659 6206,2675,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.47794393,ISDB,RYHMCEZDZZBPAQ-ISZJTHHZSA-N,"InChI=1S/C30H48O2/c1-19(18-31)20-10-13-27(4)16-17-29(6)21(25(20)27)8-9-23-28(5)14-12-24(32)26(2,3)22(28)11-15-30(23,29)7/h18,20-25,32H,1,8-17H2,2-7H3/t20-,21+,22-,23+,24+,25+,27+,28-,29+,30+/m0/s1",C=C(C=O)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H48O2,,440.365430776,RYHMCEZDZZBPAQ,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,2,9.911775708198547 6207,2671,-1,,,,0.0,MS1_match,YAVQULWQXQRTKS-QDYGYTTASA-N,"InChI=1S/C26H32O12/c1-34-18-8-13(3-5-16(18)28)7-15-12-36-25(33)26(15,10-14-4-6-17(29)19(9-14)35-2)38-24-23(32)22(31)21(30)20(11-27)37-24/h3-6,8-9,15,20-24,27-32H,7,10-12H2,1-2H3/t15-,20-,21-,22+,23-,24+,26+/m1/s1",COc1cc(C[C@@H]2COC(=O)[C@@]2(Cc2ccc(O)c(OC)c2)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C26H32O12,pos_1_1proton,536.1893764639999,YAVQULWQXQRTKS,Shikimates and Phenylpropanoids,Lignans,Dibenzylbutyrolactone lignans,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 6208,2671,-1,,,,0.0,MS1_match,YAVQULWQXQRTKS-QDYGYTTASA-N,"InChI=1S/C26H32O12/c1-34-18-8-13(3-5-16(18)28)7-15-12-36-25(33)26(15,10-14-4-6-17(29)19(9-14)35-2)38-24-23(32)22(31)21(30)20(11-27)37-24/h3-6,8-9,15,20-24,27-32H,7,10-12H2,1-2H3/t15-,20-,21-,22+,23-,24+,26+/m1/s1",COc1cc(C[C@@H]2COC(=O)[C@@]2(Cc2ccc(O)c(OC)c2)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C26H32O12,pos_1_1proton,536.1893764639999,YAVQULWQXQRTKS,Shikimates and Phenylpropanoids,Lignans,Dibenzylbutyrolactone lignans,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,0,7.0 6209,2670,-1,,,,0.45729497,ISDB,POIARNZEYGURDG-FNORWQNLSA-N,"InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8H,9H2,1-4H3/b7-5+",C/C=C/C(=O)C1=C(C)C=CCC1(C)C,C13H18O,,190.135765196,POIARNZEYGURDG,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Viburnum orientale,296902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum orientale'],5,0,6.829179883003235 6210,2668,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.26230672,ISDB,MIJYXULNPSFWEK-GTOFXWBISA-N,"InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H48O3,,456.3603453959999,MIJYXULNPSFWEK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,3,9.549226880073547 6211,2662,-1,,,,0.38327837,ISDB,ACAXZYDRDZTBIF-MAVOBODLSA-N,"InChI=1S/C24H36O5/c1-15(4-7-20(26)27)17-5-6-18-21(17,2)10-9-19-22(3)11-8-16(25)14-23(22)12-13-24(18,19)29-28-23/h12-13,15-19,25H,4-11,14H2,1-3H3,(H,26,27)/t15-,16+,17-,18-,19-,21-,22-,23-,24+/m1/s1",C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@]23C=C[C@]2(C[C@@H](O)CC[C@]12C)OO3,C24H36O5,,404.256274252,ACAXZYDRDZTBIF,Terpenoids,Steroids,Cholane steroids,Mallotus macrostachyus,762461.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus macrostachyus'],4,0,5.533113479614258 6212,2660,38,Terpenoids,Steroids,Cholestane steroids,0.58323973,ISDB,JCLCRSATHUBFEO-UHFFFAOYSA-N,"InChI=1S/C29H46O3/c1-7-21(19(2)3)9-8-20(4)23-10-11-24-26(23,5)14-13-25-27(6)15-12-22(30)18-28(27)16-17-29(24,25)32-31-28/h8-9,16-17,19-25,30H,7,10-15,18H2,1-6H3",CCC(C=CC(C)C1CCC2C1(C)CCC1C23C=CC2(CC(O)CCC12C)OO3)C(C)C,C29H46O3,,442.344695332,JCLCRSATHUBFEO,Terpenoids,Steroids,Cholestane steroids,Salta triflora,2507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Polygonaceae'],['Triplarideae'],['Salta'],['Salta triflora'],4,3,7.832958936691284 6213,2655,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,10.495584607124329 6214,2655,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,10.495584607124329 6215,2655,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,10.495584607124329 6216,2655,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,10.495584607124329 6217,2655,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.49889615,ISDB,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,10.495584607124329 6218,2651,909,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1acetonitrile,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 6219,2650,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.3926733,ISDB,OVWDRYCZWVUZQT-OMAYRMBQSA-N,"InChI=1S/C24H40O11/c1-12-7-14(8-23(3,4)15(12)6-5-13(2)26)34-21-19(29)18(28)17(27)16(35-21)9-32-22-20(30)24(31,10-25)11-33-22/h14,16-22,25,27-31H,5-11H2,1-4H3/t14-,16+,17+,18-,19+,20+,21+,22-,24-/m0/s1",CC(=O)CCC1=C(C)C[C@H](O[C@@H]2O[C@H](CO[C@H]3OC[C@@](O)(CO)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C24H40O11,,504.2570621,OVWDRYCZWVUZQT,Terpenoids,Apocarotenoids,Megastigmanes,Sargentodoxa cuneata,639710.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Lardizabalaceae'],['Unknown'],['Sargentodoxa'],['Sargentodoxa cuneata'],4,1,6.070693254470825 6220,2647,-1,,,,0.4662376,ISDB,,,,,,,ALPTZNZONYUUNE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.86495041847229 6221,2645,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.20087576,ISDB,,,,,,,STNMCYGVYVEEFU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8035030364990234 6222,2644,441,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.60011405,ISDB,LQYXTOIDTDPFSA-HCUKATGVSA-N,"InChI=1S/C36H38N4O7/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)42)32(39-25)31(34(43)36(45)47-8)33-30(35(44)46-7)19(6)26(40-33)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,37,43H,1,10-12H2,2-8H3,(H,41,42)/b24-14?,25-13?,26-15?,34-31+/t18-,22-/m0/s1",C=Cc1c2[nH]c(c1C)C=C1N=C(/C(=C(\O)C(=O)OC)C3=NC(=CC4=NC(=C2)C(C)=C4CC)C(C)=C3C(=O)OC)[C@@H](CCC(=O)O)[C@@H]1C,C36H38N4O7,,638.274049556,LQYXTOIDTDPFSA,,,,Clerodendrum calamitosum,6086132.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum calamitosum'],4,0,6.400456190109253 6223,2641,-1,,,,0.0,MS1_match,IZODPOCIKVLNIL-ZMBMZZJNSA-N,"InChI=1S/C18H28O11/c1-7-12-8(4-11(24-2)27-7)9(16(23)25-3)6-26-17(12)29-18-15(22)14(21)13(20)10(5-19)28-18/h6-8,10-15,17-22H,4-5H2,1-3H3/t7-,8+,10+,11+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](OC)C[C@H]12,C18H28O11,pos_1_sodium,420.1631617159999,IZODPOCIKVLNIL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 6224,2641,-1,,,,0.0,MS1_match,IZODPOCIKVLNIL-ZMBMZZJNSA-N,"InChI=1S/C18H28O11/c1-7-12-8(4-11(24-2)27-7)9(16(23)25-3)6-26-17(12)29-18-15(22)14(21)13(20)10(5-19)28-18/h6-8,10-15,17-22H,4-5H2,1-3H3/t7-,8+,10+,11+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](OC)C[C@H]12,C18H28O11,pos_1_sodium,420.1631617159999,IZODPOCIKVLNIL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 6225,2641,-1,,,,0.0,MS1_match,IZODPOCIKVLNIL-ZMBMZZJNSA-N,"InChI=1S/C18H28O11/c1-7-12-8(4-11(24-2)27-7)9(16(23)25-3)6-26-17(12)29-18-15(22)14(21)13(20)10(5-19)28-18/h6-8,10-15,17-22H,4-5H2,1-3H3/t7-,8+,10+,11+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](OC)C[C@H]12,C18H28O11,pos_1_sodium,420.1631617159999,IZODPOCIKVLNIL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 6226,2638,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.2179691,ISDB,OTBKATNIYSZVJP-UHFFFAOYSA-N,"InChI=1S/C17H23NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h10-11H,4-9H2,1-3H3",COc1cc(CCC(=O)N2CCCCC2=O)cc(OC)c1OC,C17H23NO5,,321.157622836,OTBKATNIYSZVJP,Alkaloids,Lysine alkaloids,,Piper swartzianum,366805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper swartzianum'],4,1,5.371876418590546 6227,2638,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.2179691,ISDB,OTBKATNIYSZVJP-UHFFFAOYSA-N,"InChI=1S/C17H23NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h10-11H,4-9H2,1-3H3",COc1cc(CCC(=O)N2CCCCC2=O)cc(OC)c1OC,C17H23NO5,,321.157622836,OTBKATNIYSZVJP,Alkaloids,Lysine alkaloids,,Piper tuberculatum,443344.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper tuberculatum'],4,1,5.371876418590546 6228,2635,-1,,,,0.76304144,ISDB,BVNVXEMVVHSCAF-SHHOIMCASA-N,"InChI=1S/C27H52O/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-27(28)25-6-4-2/h24,26H,3-23,25H2,1-2H3/b26-24+",CCCCCCCCCCCCCCCCCCCC/C=C/C(=O)CCCC,C27H52O,,392.401816284,BVNVXEMVVHSCAF,Fatty acids,Fatty acyls,Hydrocarbons,Ulva lactuca,13962.0,['Eukaryota'],['Archaeplastida'],['Chlorophyta'],['Ulvophyceae'],['Ulvales'],['Ulvaceae'],['Unknown'],['Ulva'],['Ulva lactuca'],2,0,5.052165746688843 6229,2634,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,QIQXTHQIDYTFRH-UHFFFAOYSA-N,"InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)",CCCCCCCCCCCCCCCCCC(=O)O,C18H36O2,pos_1_1proton1acetonitrile,284.271530392,QIQXTHQIDYTFRH,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,3,7.5 6230,2633,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_1proton1methanol,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 6231,2633,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_1proton1methanol,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 6232,2633,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_1proton1methanol,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 6233,2633,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_1proton1methanol,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 6234,2629,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.21589819,ISDB,,,,,,,RZNKFJZERMQCFT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8635927438735962 6235,2628,-1,,,,0.0,MS1_match,JJUCBHSRJQINGH-YGUDKLPYSA-N,"InChI=1S/C14H24O4/c1-12(2)8-6-10(16)13(3)11(17)9(15)4-5-14(13,7-8)18-12/h8-11,15-17H,4-7H2,1-3H3/t8-,9+,10+,11+,13-,14-/m1/s1",CC1(C)O[C@@]23CC[C@H](O)[C@H](O)[C@@]2(C)[C@@H](O)C[C@@H]1C3,C14H24O4,pos_1_sodium,256.167459248,JJUCBHSRJQINGH,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,0,6.0 6236,2627,-1,,,,0.2765777,ISDB,XSAPVTUEGDPTEC-ZBEZCMNISA-N,"InChI=1S/C14H19NO4/c1-8-11(17)15-14(12(18)19-13(8,14)2)10(16)9-6-4-3-5-7-9/h4,6,8-10,16H,3,5,7H2,1-2H3,(H,15,17)/t8-,9-,10+,13+,14+/m1/s1",C[C@@H]1C(=O)N[C@@]2([C@@H](O)[C@@H]3C=CCCC3)C(=O)O[C@@]12C,C14H19NO4,,265.131408088,XSAPVTUEGDPTEC,Amino acids and Peptides,γ-lactam-β-lactones,Salinosporamides,Salinispora tropica,530014.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Micromonosporales'],['Micromonosporaceae'],['Unknown'],['Salinispora'],['Salinispora tropica'],0,0,1.1063108444213867 6237,2626,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.2825981,ISDB,SACPYSHBQFRBLR-AWEZNQCLSA-N,"InChI=1S/C14H15NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7,14-15H,1-3H3/t14-/m0/s1",COC1=C2C=CO[C@@H]2Nc2c1ccc(OC)c2OC,C14H15NO4,,261.10010796,SACPYSHBQFRBLR,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Melicope triphylla,710074.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Melicope'],['Melicope triphylla'],4,1,5.63039243221283 6238,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-YLFNNMARSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Crassocephalum crepidioides,65665.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Crassocephalum'],['Crassocephalum crepidioides'],4,2,6.733917951583862 6239,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-UHFFFAOYSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3",CC1CC2(OC2C)C(=O)OC2CCN3CC=C(COC(=O)C1(C)O)C23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Senecio scandens,742757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Senecio'],['Senecio scandens'],4,2,6.733917951583862 6240,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-YLFNNMARSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Jacobaea erucifolia,117046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Jacobaea'],['Jacobaea erucifolia'],4,2,6.733917951583862 6241,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-PECZWXESSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11+,13?,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@H]2C)C(=O)OC2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818752,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Senecio pterophorus,792673.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Senecio'],['Senecio pterophorus'],4,2,6.733917951583862 6242,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-YLFNNMARSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Senecio aquaticus,117022.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Jacobaea'],['Jacobaea aquatica'],4,2,6.733917951583862 6243,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-YLFNNMARSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Jacobaea aquatica,117022.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Jacobaea'],['Jacobaea aquatica'],4,2,6.733917951583862 6244,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-YLFNNMARSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Senecio vulgaris,754105.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Senecio'],['Senecio vulgaris'],4,2,6.733917951583862 6245,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-WKMWQDDRSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11+,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818752,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Senecio brasiliensis,1031495.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Senecio'],['Senecio brasiliensis'],4,2,6.733917951583862 6246,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-WKMWQDDRSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11+,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818752,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Senecio incanus,117042.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Jacobaea'],['Jacobaea incana'],4,2,6.733917951583862 6247,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-WKMWQDDRSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11+,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818752,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Jacobaea cannabifolia,117029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Jacobaea'],['Jacobaea cannabifolia'],4,2,6.733917951583862 6248,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-WKMWQDDRSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11+,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818752,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Jacobaea gnaphalioides,577409.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Jacobaea'],['Jacobaea gnaphalioides'],4,2,6.733917951583862 6249,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-WKMWQDDRSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11+,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818752,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Jacobaea vulgaris,238719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Jacobaea'],['Jacobaea vulgaris'],4,2,6.733917951583862 6250,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-YLFNNMARSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Crotalaria anagyroides,7633465.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Crotalarieae'],['Crotalaria'],['Crotalaria anagyroides'],4,2,6.733917951583862 6251,2623,15,Alkaloids,Ornithine alkaloids,Flavan-3-ols,0.4334795,ISDB,IAPHXJRHXBQDQJ-YLFNNMARSA-N,"InChI=1S/C18H25NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1",C[C@@H]1C[C@@]2(O[C@@H]2C)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23,C18H25NO6,,351.16818751999995,IAPHXJRHXBQDQJ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Crotalaria micans,227361.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Crotalarieae'],['Crotalaria'],['Crotalaria micans'],4,2,6.733917951583862 6252,2621,-1,,,,0.0,MS1_match,VQSGSHVNMAGNDE-UHFFFAOYSA-N,"InChI=1S/C12H12O3/c1-2-14-6-10-7-15-8-12-9(5-13)3-4-11(10)12/h3-5,7-8H,2,6H2,1H3",CCOCc1cocc2c(C=O)ccc1-2,C12H12O3,pos_1_1proton1methanol,204.078644244,VQSGSHVNMAGNDE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 6253,2621,-1,,,,0.0,MS1_match,VQSGSHVNMAGNDE-UHFFFAOYSA-N,"InChI=1S/C12H12O3/c1-2-14-6-10-7-15-8-12-9(5-13)3-4-11(10)12/h3-5,7-8H,2,6H2,1H3",CCOCc1cocc2c(C=O)ccc1-2,C12H12O3,pos_1_1proton1methanol,204.078644244,VQSGSHVNMAGNDE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,0,6.0 6254,2620,-1,,,,0.0,MS1_match,JVAVVXRDSNKYPD-UHFFFAOYSA-N,"InChI=1S/C15H20O4/c1-9-4-3-5-11(15(17)18)7-12-8-13(12)14(6-9)19-10(2)16/h4,7,12-14H,3,5-6,8H2,1-2H3,(H,17,18)",CC(=O)OC1CC(C)=CCCC(C(=O)O)=CC2CC21,C15H20O4,pos_1_1proton1methanol,264.13615912,JVAVVXRDSNKYPD,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6255,2620,-1,,,,0.0,MS1_match,JVAVVXRDSNKYPD-UHFFFAOYSA-N,"InChI=1S/C15H20O4/c1-9-4-3-5-11(15(17)18)7-12-8-13(12)14(6-9)19-10(2)16/h4,7,12-14H,3,5-6,8H2,1-2H3,(H,17,18)",CC(=O)OC1CC(C)=CCCC(C(=O)O)=CC2CC21,C15H20O4,pos_1_1proton1methanol,264.13615912,JVAVVXRDSNKYPD,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 6256,2620,-1,,,,0.0,MS1_match,GYTISTMGTHKMCE-RMHXPDDSSA-N,"InChI=1S/C15H20O4/c1-7-5-8(16)6-9-10(17)11-12(19-11)13(14(2,3)18)15(7,9)4/h6-7,11-13,18H,5H2,1-4H3/t7-,11-,12-,13+,15+/m1/s1",C[C@@H]1CC(=O)C=C2C(=O)[C@H]3O[C@H]3[C@@H](C(C)(C)O)[C@]21C,C15H20O4,pos_1_1proton1methanol,264.13615912,GYTISTMGTHKMCE,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 6257,2618,-1,,,,0.22808121,ISDB,,,,,,,CQROFWZEURPZRP,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.912324845790863 6258,2614,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.5484605,ISDB,VZZQQZMZDJETCS-GUKRZAEASA-N,"InChI=1S/C20H20O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-4,6-9,11-13,21-22,24H,5,10H2,1H3/b9-4+,17-13-",COc1cc(CCC(=O)/C=C(O)/C=C/c2ccc(O)cc2)ccc1O,C20H20O5,,340.13107374,VZZQQZMZDJETCS,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Aframomum letestuanum,791472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Aframomum'],['Aframomum letestuanum'],4,3,7.693841934204102 6259,2613,-1,,,,0.37886128,ISDB,IVQLNJTZWHCVDN-JMSRHPTLSA-N,"InChI=1S/C16H28O8/c1-9(6-7-17)4-3-5-10(2)15(22)24-16-14(21)13(20)12(19)11(8-18)23-16/h5,9,11-14,16-21H,3-4,6-8H2,1-2H3/b10-5+/t9-,11+,12+,13-,14+,16-/m0/s1",C/C(=C\CC[C@H](C)CCO)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O8,,348.178417856,IVQLNJTZWHCVDN,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Sambucus ebulus,22350.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Sambucus'],['Sambucus ebulus'],5,0,6.515445113182068 6260,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-QFVDPHNQSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12-,13-,14+,17-,18-,19-,20+,21-,22-,25+,26-,27-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.210505832,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus fullonum,994148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus fullonum'],6,0,6.0 6261,2610,-1,,,,0.0,MS1_match,JGTLWLBBZPVAFK-UHFFFAOYSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)16(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)23(33)39-17-7-14-15(11(17)2)9-37-25(35)19(14)24(34)36-3/h4,6,10-15,17-22,26-27,29-32H,1,5,7-9H2,2-3H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC2CC3C(C(=O)OC)C(=O)OCC3C2C)C1CC=O,C27H36O14,pos_2_2proton,584.210505832,JGTLWLBBZPVAFK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 6262,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-QFVDPHNQSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12-,13-,14+,17-,18-,19-,20+,21-,22-,25+,26-,27-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.210505832,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus sylvestris,994148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus fullonum'],6,0,6.0 6263,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-QFVDPHNQSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12-,13-,14+,17-,18-,19-,20+,21-,22-,25+,26-,27-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.210505832,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus fullonum,994148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus fullonum'],6,0,6.0 6264,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-CQWPOWKPSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12+,13-,14+,17-,18+,19+,20+,21-,22+,25+,26-,27-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.2105058319999,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 6265,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-CQWPOWKPSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12+,13-,14+,17-,18+,19+,20+,21-,22+,25+,26-,27-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.2105058319999,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Abelia chinensis,589178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Abelia'],['Abelia chinensis'],6,0,6.0 6266,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-QFVDPHNQSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12-,13-,14+,17-,18-,19-,20+,21-,22-,25+,26-,27-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.210505832,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus sylvestris,994148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus fullonum'],6,0,6.0 6267,2610,-1,,,,0.0,MS1_match,JGTLWLBBZPVAFK-UWFCLSDTSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)16(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)23(33)39-17-7-14-15(11(17)2)9-37-25(35)19(14)24(34)36-3/h4,6,10-15,17-22,26-27,29-32H,1,5,7-9H2,2-3H3/t11-,12+,13-,14-,15+,17+,18-,19-,20+,21+,22+,26+,27+/m1/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)OC=C(C(=O)O[C@H]2C[C@H]3[C@H](C(=O)OC)C(=O)OC[C@H]3[C@H]2C)[C@@H]1CC=O,C27H36O14,pos_2_2proton,584.210505832,JGTLWLBBZPVAFK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus fullonum,994148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus fullonum'],6,0,6.0 6268,2610,-1,,,,0.0,MS1_match,JGTLWLBBZPVAFK-UWFCLSDTSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)16(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)23(33)39-17-7-14-15(11(17)2)9-37-25(35)19(14)24(34)36-3/h4,6,10-15,17-22,26-27,29-32H,1,5,7-9H2,2-3H3/t11-,12+,13-,14-,15+,17+,18-,19-,20+,21+,22+,26+,27+/m1/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)OC=C(C(=O)O[C@H]2C[C@H]3[C@H](C(=O)OC)C(=O)OC[C@H]3[C@H]2C)[C@@H]1CC=O,C27H36O14,pos_2_2proton,584.210505832,JGTLWLBBZPVAFK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus sylvestris,994148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus fullonum'],6,0,6.0 6269,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-CQWPOWKPSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12+,13-,14+,17-,18+,19+,20+,21-,22+,25+,26-,27-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.2105058319999,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Abelia chinensis,589178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Abelia'],['Abelia chinensis'],6,0,6.0 6270,2610,-1,,,,0.0,MS1_match,UOBZWMPWXPIGBV-UHFFFAOYSA-N,"InChI=1S/C15H20O3/c1-14(2)11-5-6-15(9-17)13(18-15)4-3-10(8-16)7-12(11)14/h7-9,11-13H,3-6H2,1-2H3",CC1(C)C2C=C(C=O)CCC3OC3(C=O)CCC21,C15H20O3,pos_1_minus1proton2sodium,248.1412445,UOBZWMPWXPIGBV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6271,2610,-1,,,,0.0,MS1_match,UOBZWMPWXPIGBV-UHFFFAOYSA-N,"InChI=1S/C15H20O3/c1-14(2)11-5-6-15(9-17)13(18-15)4-3-10(8-16)7-12(11)14/h7-9,11-13H,3-6H2,1-2H3",CC1(C)C2C=C(C=O)CCC3OC3(C=O)CCC21,C15H20O3,pos_1_minus1proton2sodium,248.1412445,UOBZWMPWXPIGBV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 6272,2610,-1,,,,0.0,MS1_match,NGUGLLPTHUYIGI-CKRUZVNXSA-N,"InChI=1S/C15H20O3/c1-7-5-6-8-15(18-8)12(17)10(16)9-11(13(9,2)3)14(7,15)4/h7-9,11H,5-6H2,1-4H3/t7-,8+,9-,11+,14-,15-/m1/s1",C[C@@H]1CC[C@@H]2O[C@@]23C(=O)C(=O)[C@@H]2[C@@H](C2(C)C)[C@@]13C,C15H20O3,pos_1_minus1proton2sodium,248.1412445,NGUGLLPTHUYIGI,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 6273,2610,-1,,,,0.0,MS1_match,PLUVLWUSXQCTNH-UHFFFAOYSA-N,"InChI=1S/C15H20O3/c1-5-6-12-7-8-13(14(10-12)17-4)18-15(16)9-11(2)3/h5,7-8,10-11H,1,6,9H2,2-4H3",C=CCc1ccc(OC(=O)CC(C)C)c(OC)c1,C15H20O3,pos_1_minus1proton2sodium,248.1412445,PLUVLWUSXQCTNH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6274,2610,-1,,,,0.0,MS1_match,IAXYZHODIUFGKB-CQWPOWKPSA-N,"InChI=1S/C27H36O14/c1-4-12-13(5-6-28)15(10-38-26(12)41-27-22(32)21(31)20(30)18(8-29)40-27)24(34)39-17-7-14-16(23(33)36-3)9-37-25(35)19(14)11(17)2/h4,6,9-14,17-22,25-27,29-32,35H,1,5,7-8H2,2-3H3/t11-,12+,13-,14+,17-,18+,19+,20+,21-,22+,25+,26-,27-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O)[C@@H]3[C@H]2C)[C@H]1CC=O,C27H36O14,pos_2_2proton,584.2105058319999,IAXYZHODIUFGKB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 6275,2609,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_sodium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6276,2609,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_sodium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6277,2608,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.44688004,ISDB,BCNPTKKIVMTZFO-BWEORVRESA-N,"InChI=1S/C22H30O2/c1-17(9-6-7-14-23)10-8-11-18(2)12-13-21-19(3)15-20(24)16-22(21,4)5/h6-14,20,24H,15-16H2,1-5H3/b7-6+,10-8+,13-12+,17-9-,18-11+/t20-/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C\C=C\C=O)C(C)(C)C[C@H](O)C1,C22H30O2,,326.2245802,BCNPTKKIVMTZFO,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],0,1,2.287520170211792 6278,2608,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.44688004,ISDB,BCNPTKKIVMTZFO-UHFFFAOYSA-N,"InChI=1S/C22H30O2/c1-17(9-6-7-14-23)10-8-11-18(2)12-13-21-19(3)15-20(24)16-22(21,4)5/h6-14,20,24H,15-16H2,1-5H3",CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=O,C22H30O2,,326.2245802,BCNPTKKIVMTZFO,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],0,1,2.287520170211792 6279,2606,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.43773374,ISDB,OZOLQBVPEIWKPL-ARJAWSKDSA-N,"InChI=1S/C22H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h1,3-4,23H,5-8,11-14,17-19,22H2/b4-3-",C#C/C=C\CCCCC#CCCCCC#CCCCC#CCO,C22H28O,,308.214015516,OZOLQBVPEIWKPL,Fatty acids,Fatty acyls,Fatty alcohols,Callyspongia,1031750.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Haplosclerida'],['Callyspongiidae'],['Unknown'],['Callyspongia'],['Unknown'],0,0,1.7509349584579468 6280,2605,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_2_2proton2acetonitrile,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 6281,2605,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JOBWUMLSLUCCJM-OHJXWDBTSA-N,"InChI=1S/C27H34O16/c1-10-4-12(29)17-13(30)5-14-11(24(17)41-10)2-3-27(37,8-39-14)9-40-26-23(36)21(34)19(32)16(43-26)7-38-25-22(35)20(33)18(31)15(6-28)42-25/h2-5,15-16,18-23,25-26,28,30-37H,6-9H2,1H3/t15-,16-,18-,19-,20+,21+,22-,23-,25-,26-,27+/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)C=C[C@@](O)(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O16,pos_2_2proton2acetonitrile,614.184685008,JOBWUMLSLUCCJM,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 6282,2605,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RTWCTRFVACGXAD-FUEGPVBASA-N,"InChI=1S/C32H44O14/c1-16(10-11-41-22-13-20-19(12-21(22)40-4)8-9-24(33)45-20)6-5-7-17(2)14-42-32-30(39)28(37)26(35)23(46-32)15-43-31-29(38)27(36)25(34)18(3)44-31/h7-10,12-13,18,23,25-32,34-39H,5-6,11,14-15H2,1-4H3/b16-10+,17-7-/t18-,23+,25-,26+,27+,28-,29+,30+,31+,32+/m0/s1",COc1cc2ccc(=O)oc2cc1OC/C=C(\C)CC/C=C(/C)CO[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C32H44O14,pos_2_2sodium,652.273106088,RTWCTRFVACGXAD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Coptis trifolia,982768.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis trifolia'],6,0,6.0 6283,2603,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.81906223,ISDB,JSKJPUCKVIJTKI-UHFFFAOYSA-N,"InChI=1S/C22H43O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(26)29-17-21(25)19-31-32(27,28)30-18-20(24)16-23/h7-8,20-21,23-25H,2-6,9-19H2,1H3,(H,27,28)",CCCCCCC=CCCCCCCCC(=O)OCC(O)COP(=O)(O)OCC(O)CO,C22H43O9P,,482.2644695859999,JSKJPUCKVIJTKI,Fatty acids,Glycerophospholipids,Glycerophosphoglycerols,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,1,7.776248931884766 6284,2599,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.39193168,ISDB,ZFHFRLPFRLZAPJ-IVOUXGOCSA-N,"InChI=1S/C51H82O15/c1-25-24-61-42(27(3)26(25)2)65-40-37(56)36(55)39(41(58)60-11)64-44(40)63-33-15-16-48(8)31(47(33,6)7)14-17-50(10)32(48)13-12-28-29-22-46(4,5)18-20-51(29,21-19-49(28,50)9)45(59)66-43-38(57)35(54)34(53)30(23-52)62-43/h12,25-27,29-40,42-44,52-57H,13-24H2,1-11H3/t25-,26+,27-,29+,30-,31+,32-,33+,34-,35+,36+,37+,38-,39+,40-,42+,43+,44-,48+,49-,50-,51+/m1/s1",COC(=O)[C@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O[C@@H]2OC[C@@H](C)[C@H](C)[C@H]2C)[C@@H](O)[C@@H]1O,C51H82O15,,934.565371924,ZFHFRLPFRLZAPJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Panax stipuleanatus,160834.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax stipuleanatus'],4,0,5.567726731300354 6285,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-BWALXXMCSA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25+/t37-,38+,39+,40+,41-,42+,43-,44+,46+/m0/s1",CCCCCCCCC/C=C/CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.648648048,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Juglans mandshurica,70093.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Juglans'],['Juglans mandshurica'],4,3,6.4361186027526855 6286,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-YDZHOCLMSA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25-/t37-,38+,39+,40+,41-,42+,43-,44+,46+/m0/s1",CCCCCCCCC/C=C\CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.6486480479999,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Euphorbia nicaeensis,181008.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Euphorbieae'],['Euphorbia'],['Euphorbia nicaeensis'],4,3,6.4361186027526855 6287,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-BWALXXMCSA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25+/t37-,38+,39+,40+,41-,42+,43-,44+,46+/m0/s1",CCCCCCCCC/C=C/CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.648648048,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,3,6.4361186027526855 6288,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-YDZHOCLMSA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25-/t37-,38+,39+,40+,41-,42+,43-,44+,46+/m0/s1",CCCCCCCCC/C=C\CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.6486480479999,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Craibiodendron yunnanense,369596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Lyonieae'],['Craibiodendron'],['Craibiodendron yunnanense'],4,3,6.4361186027526855 6289,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-DGJSVMKESA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25-/t37-,38+,39+,40+,41-,42-,43-,44+,46+/m0/s1",CCCCCCCCC/C=C\CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.648648048,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Euphorbia peplis,587391.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Euphorbieae'],['Euphorbia'],['Euphorbia peplis'],4,3,6.4361186027526855 6290,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-DGJSVMKESA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25-/t37-,38+,39+,40+,41-,42-,43-,44+,46+/m0/s1",CCCCCCCCC/C=C\CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.648648048,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Euphorbia peplus,871281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Euphorbieae'],['Euphorbia'],['Euphorbia peplus'],4,3,6.4361186027526855 6291,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-YDZHOCLMSA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25-/t37-,38+,39+,40+,41-,42+,43-,44+,46+/m0/s1",CCCCCCCCC/C=C\CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.6486480479999,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Ocimum tenuiflorum,782204.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Ocimum'],['Ocimum tenuiflorum'],4,3,6.4361186027526855 6292,2596,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.23402965,ISDB,UPNWIBPHYOJXOA-BWALXXMCSA-N,"InChI=1S/C46H89NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-39(50)45(55)47-37(36-56-46-44(54)43(53)42(52)40(35-48)57-46)41(51)38(49)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,37-44,46,48-54H,3-24,26,28-36H2,1-2H3,(H,47,55)/b27-25+/t37-,38+,39+,40+,41-,42+,43-,44+,46+/m0/s1",CCCCCCCCC/C=C/CCC[C@@H](O)[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCC,C46H89NO10,,815.648648048,UPNWIBPHYOJXOA,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Rhaponticum chinense,27810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Klaseopsis'],['Klaseopsis chinensis'],4,3,6.4361186027526855 6293,2591,-1,,,,0.23000921,ISDB,JDKUSIUPEUOZEW-MUFKJQONSA-N,"InChI=1S/C24H38O6/c1-16(11-13-25)10-12-23(3)18(15-30-22(29)9-8-21(27)28)19(26)14-24(4)17(2)6-5-7-20(23)24/h6,11,18-20,25-26H,5,7-10,12-15H2,1-4H3,(H,27,28)/b16-11+/t18-,19+,20-,23+,24+/m1/s1",CC1=CCC[C@@H]2[C@@](C)(CC/C(C)=C/CO)[C@H](COC(=O)CCC(=O)O)[C@@H](O)C[C@@]12C,C24H38O6,,422.266838936,JDKUSIUPEUOZEW,Terpenoids,Diterpenoids,Colensane and Clerodane diterpenoids,Baccharis pteronioides,3898913.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Baccharis'],['Baccharis pteronioides'],4,0,4.920036852359772 6294,2590,887,Terpenoids,Sesquiterpenoids,Acyclic monoterpenoids,0.4846947,ISDB,NSCUDPABUZNJRT-JURCDPSOSA-N,"InChI=1S/C15H24O4/c1-6-14(5)8-7-12(17-14)11(2)15(16)10-9-13(3,4)18-19-15/h6,9-12,16H,1,7-8H2,2-5H3/t11-,12-,14-,15-/m0/s1",C=C[C@@]1(C)CC[C@@H]([C@H](C)[C@]2(O)C=CC(C)(C)OO2)O1,C15H24O4,,268.167459248,NSCUDPABUZNJRT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Artemisia reptans,1063447.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia reptans'],4,3,7.438778758049011 6295,2590,887,Terpenoids,Sesquiterpenoids,Acyclic monoterpenoids,0.4846947,ISDB,NSCUDPABUZNJRT-JURCDPSOSA-N,"InChI=1S/C15H24O4/c1-6-14(5)8-7-12(17-14)11(2)15(16)10-9-13(3,4)18-19-15/h6,9-12,16H,1,7-8H2,2-5H3/t11-,12-,14-,15-/m0/s1",C=C[C@@]1(C)CC[C@@H]([C@H](C)[C@]2(O)C=CC(C)(C)OO2)O1,C15H24O4,,268.167459248,NSCUDPABUZNJRT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Tanacetum vulgare,602516.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Tanacetum'],['Tanacetum vulgare'],4,3,7.438778758049011 6296,2590,887,Terpenoids,Sesquiterpenoids,Acyclic monoterpenoids,0.4846947,ISDB,NSCUDPABUZNJRT-JURCDPSOSA-N,"InChI=1S/C15H24O4/c1-6-14(5)8-7-12(17-14)11(2)15(16)10-9-13(3,4)18-19-15/h6,9-12,16H,1,7-8H2,2-5H3/t11-,12-,14-,15-/m0/s1",C=C[C@@]1(C)CC[C@@H]([C@H](C)[C@]2(O)C=CC(C)(C)OO2)O1,C15H24O4,,268.167459248,NSCUDPABUZNJRT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Artemisia inculta,969157.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia inculta'],4,3,7.438778758049011 6297,2590,887,Terpenoids,Sesquiterpenoids,Acyclic monoterpenoids,0.4846947,ISDB,NSCUDPABUZNJRT-JURCDPSOSA-N,"InChI=1S/C15H24O4/c1-6-14(5)8-7-12(17-14)11(2)15(16)10-9-13(3,4)18-19-15/h6,9-12,16H,1,7-8H2,2-5H3/t11-,12-,14-,15-/m0/s1",C=C[C@@]1(C)CC[C@@H]([C@H](C)[C@]2(O)C=CC(C)(C)OO2)O1,C15H24O4,,268.167459248,NSCUDPABUZNJRT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Artemisia deserti,220486.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia deserti'],4,3,7.438778758049011 6298,2590,887,Terpenoids,Sesquiterpenoids,Acyclic monoterpenoids,0.4846947,ISDB,NSCUDPABUZNJRT-GHJRKTJFSA-N,"InChI=1S/C15H24O4/c1-6-14(5)8-7-12(17-14)11(2)15(16)10-9-13(3,4)18-19-15/h6,9-12,16H,1,7-8H2,2-5H3/t11-,12-,14-,15?/m0/s1",C=C[C@@]1(C)CC[C@@H]([C@H](C)C2(O)C=CC(C)(C)OO2)O1,C15H24O4,,268.167459248,NSCUDPABUZNJRT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Artemisia herba-alba,693395.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia herba-alba'],4,3,7.438778758049011 6299,2590,887,Terpenoids,Sesquiterpenoids,Acyclic monoterpenoids,0.4846947,ISDB,NSCUDPABUZNJRT-JURCDPSOSA-N,"InChI=1S/C15H24O4/c1-6-14(5)8-7-12(17-14)11(2)15(16)10-9-13(3,4)18-19-15/h6,9-12,16H,1,7-8H2,2-5H3/t11-,12-,14-,15-/m0/s1",C=C[C@@]1(C)CC[C@@H]([C@H](C)[C@]2(O)C=CC(C)(C)OO2)O1,C15H24O4,,268.167459248,NSCUDPABUZNJRT,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Artemisia abrotanum,725860.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia abrotanum'],4,3,7.438778758049011 6300,2589,-1,,,,0.3780985,ISDB,LGFCSRDJBFILEF-UHFFFAOYSA-N,"InChI=1S/C18H19NO6/c1-19(9-20)16-6-12(22-2)3-4-18(16)13-7-15-14(24-10-25-15)5-11(13)8-23-17(18)21/h3-5,7,9,12,16H,6,8,10H2,1-2H3",COC1C=CC2(C(=O)OCc3cc4c(cc32)OCO4)C(N(C)C=O)C1,C18H19NO6,,345.121237328,LGFCSRDJBFILEF,,,,Narcissus,592259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Narcissus'],['Unknown'],4,0,5.512393951416016 6301,2585,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.34186107,ISDB,,,,,,,YRALWAZPKOOADH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3674442768096924 6302,2584,-1,,,,0.6672008,ISDB,BCTBHOXCGJDKFZ-PLJUSGQGSA-N,"InChI=1S/C16H28O7/c1-16(2,21)10-5-3-9(4-6-10)8-22-15-14(20)13(19)12(18)11(7-17)23-15/h3,10-15,17-21H,4-8H2,1-2H3/t10-,11-,12-,13+,14-,15-/m1/s1",CC(C)(O)[C@@H]1CC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC1,C16H28O7,,332.183503236,BCTBHOXCGJDKFZ,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Sedum sarmentosum,810620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Crassulaceae'],['Unknown'],['Sedum'],['Sedum sarmentosum'],4,0,6.6688032150268555 6303,2578,336,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XACDKHBZZCTLAX-LYPCXQPCSA-N,"InChI=1S/C25H34O10/c1-7-14(4)8-20(28)35-24-21-18(9-19(33-15(5)26)25(21)12-32-25)17(11-31-24)10-30-23(29)22(13(2)3)34-16(6)27/h9,11,13-14,19,21-22,24H,7-8,10,12H2,1-6H3/t14-,19-,21+,22+,24-,25+/m0/s1",CC[C@H](C)CC(=O)O[C@@H]1OC=C(COC(=O)[C@H](OC(C)=O)C(C)C)C2=C[C@H](OC(C)=O)[C@]3(CO3)[C@H]21,C25H34O10,pos_1_1proton1ammonium,494.215197288,XACDKHBZZCTLAX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6304,2578,336,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QJEWSMDVLSEWAR-NUXWWDJCSA-N,"InChI=1S/C25H34O10/c1-7-14(2)8-20(28)34-23-22-18(17(12-31-23)11-30-15(3)26)9-19(25(22)13-32-25)33-21(29)10-24(5,6)35-16(4)27/h9,12,14,19,22-23H,7-8,10-11,13H2,1-6H3/t14-,19+,22-,23+,25-/m1/s1",CC[C@@H](C)CC(=O)O[C@@H]1OC=C(COC(C)=O)C2=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]3(CO3)[C@H]21,C25H34O10,pos_1_1proton1ammonium,494.215197288,QJEWSMDVLSEWAR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6305,2575,372,Fatty acids,Fatty Acids and Conjugates,Fatty alcohols,0.25345242,ISDB,YJPSPAUZXUUWRY-SSBOKUKZSA-N,"InChI=1S/C29H60O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25-28(31)29(32)26-27(30)24-22-8-6-4-2/h27-32H,3-26H2,1-2H3/t27-,28+,29-/m1/s1",CCCCCCCCCCCCCCCCCCC[C@H](O)[C@H](O)C[C@H](O)CCCCCC,C29H60O3,,456.45424578,YJPSPAUZXUUWRY,Fatty acids,Fatty acyls,Fatty alcohols,Typha angustifolia,17923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Typhaceae'],['Unknown'],['Typha'],['Typha angustifolia'],4,3,6.513809680938721 6306,2574,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CRSFLLTWRCYNNX-QBNNUVSCSA-N,"InChI=1S/C16H18O10/c1-23-7-4-6-2-3-9(18)25-14(6)15(11(7)20)26-16-13(22)12(21)10(19)8(5-17)24-16/h2-4,8,10,12-13,16-17,19-22H,5H2,1H3/t8-,10-,12+,13-,16+/m1/s1",COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O,C16H18O10,pos_1_sodium,370.0899967759999,CRSFLLTWRCYNNX,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 6307,2574,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CRSFLLTWRCYNNX-QBNNUVSCSA-N,"InChI=1S/C16H18O10/c1-23-7-4-6-2-3-9(18)25-14(6)15(11(7)20)26-16-13(22)12(21)10(19)8(5-17)24-16/h2-4,8,10,12-13,16-17,19-22H,5H2,1H3/t8-,10-,12+,13-,16+/m1/s1",COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O,C16H18O10,pos_1_sodium,370.0899967759999,CRSFLLTWRCYNNX,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 6308,2568,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.6935779,ISDB,QRGXNNLNKJPFIX-LBPRGKRZSA-N,"InChI=1S/C12H16O3/c1-9-4-6-11(7-5-9)12(3,14)8-15-10(2)13/h4-7,14H,8H2,1-3H3/t12-/m0/s1",CC(=O)OC[C@](C)(O)c1ccc(C)cc1,C12H16O3,,208.109944372,QRGXNNLNKJPFIX,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Haplopappus remyanus,7599243.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Haplopappus'],['Haplopappus remyanus'],4,2,7.774311542510986 6309,2565,-1,,,,0.31665325,ISDB,AWUNHMGGXOAUQB-UHFFFAOYSA-N,"InChI=1S/C15H16N2O6/c18-12(15(22)23)6-13(19)17-11(14(20)21)5-8-7-16-10-4-2-1-3-9(8)10/h1-4,7,11-12,16,18H,5-6H2,(H,17,19)(H,20,21)(H,22,23)",O=C(CC(O)C(=O)O)NC(Cc1c[nH]c2ccccc12)C(=O)O,C15H16N2O6,,320.100836232,AWUNHMGGXOAUQB,Amino acids and Peptides,Small peptides,Dipeptides,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,5.266613006591797 6310,2562,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.2982386,ISDB,HAIPHKFLSXSDAN-BLOCXYQCSA-N,"InChI=1S/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,31,33,42H,6-7,9,11-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H76NO8P,,777.530855022,HAIPHKFLSXSDAN,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,3.692954421043396 6311,2562,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.2982386,ISDB,HAIPHKFLSXSDAN-BLOCXYQCSA-N,"InChI=1S/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,31,33,42H,6-7,9,11-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H76NO8P,,777.530855022,HAIPHKFLSXSDAN,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,3.692954421043396 6312,2558,-1,,,,0.0,MS1_match,OUWXZGMEFZQYEK-WQLSENKSSA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(8-12(4)16(17)18)15-11(3)7-10(2)14(9)15/h8-10,13-14H,5-7H2,1-4H3,(H,17,18)/b12-8-",CC1=C2C(/C=C(/C)C(=O)O)CCC(C)C2C(C)C1,C16H24O2,pos_1_minus1proton2sodium,248.177630008,OUWXZGMEFZQYEK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6313,2558,-1,,,,0.0,MS1_match,QZOHYBQLEGSTNQ-JQNTVMKESA-N,"InChI=1S/C29H44O12/c1-16(2)9-23(32)36-13-20-14-37-27(40-24(33)10-17(3)4)26-21(20)11-22(39-18(5)30)29(26,35)15-38-25(34)12-28(7,8)41-19(6)31/h14,16-17,21-22,26-27,35H,9-13,15H2,1-8H3/t21-,22+,26-,27+,29-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)(C)OC(C)=O,C29H44O12,pos_2_2proton,584.2832768479999,QZOHYBQLEGSTNQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 6314,2558,-1,,,,0.0,MS1_match,QZOHYBQLEGSTNQ-JQNTVMKESA-N,"InChI=1S/C29H44O12/c1-16(2)9-23(32)36-13-20-14-37-27(40-24(33)10-17(3)4)26-21(20)11-22(39-18(5)30)29(26,35)15-38-25(34)12-28(7,8)41-19(6)31/h14,16-17,21-22,26-27,35H,9-13,15H2,1-8H3/t21-,22+,26-,27+,29-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)(C)OC(C)=O,C29H44O12,pos_2_2proton,584.2832768479999,QZOHYBQLEGSTNQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 6315,2555,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.26137757,ISDB,XYCYUUSEIAGVKO-UYMHYVCLSA-N,"InChI=1S/C33H42O18/c1-13-26(46-14(2)36)25(42)28(48-20(38)7-5-15-4-6-18(43-3)17(37)10-15)32(45-13)49-27-16-8-9-44-30(21(16)33(12-35)29(27)51-33)50-31-24(41)23(40)22(39)19(11-34)47-31/h4-10,13,16,19,21-32,34-35,37,39-42H,11-12H2,1-3H3/b7-5+/t13-,16+,19+,21+,22+,23-,24+,25+,26-,27-,28+,29-,30-,31-,32-,33+/m0/s1",COc1ccc(/C=C/C(=O)O[C@H]2[C@H](O[C@H]3[C@@H]4C=CO[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H]4[C@@]4(CO)O[C@@H]34)O[C@@H](C)[C@H](OC(C)=O)[C@H]2O)cc1O,C33H42O18,,726.237114504,XYCYUUSEIAGVKO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Premna microphylla,503286.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Premna'],['Premna microphylla'],4,2,6.045510292053223 6316,2554,-1,,,,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2sodium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6317,2554,-1,,,,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2sodium,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6318,2554,-1,,,,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2sodium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 6319,2554,-1,,,,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2sodium,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 6320,2554,-1,,,,0.0,MS1_match,ORESVIJUAVPRJL-XUJNLDPJSA-N,"InChI=1S/C42H68O14/c1-20(2)21-9-14-42(37(52)56-36-34(51)32(49)30(47)24(18-44)54-36)16-15-40(5)22(28(21)42)7-8-26-38(3)12-11-27(39(4,19-45)25(38)10-13-41(26,40)6)55-35-33(50)31(48)29(46)23(17-43)53-35/h21-36,43-51H,1,7-19H2,2-6H3/t21-,22+,23+,24+,25+,26+,27-,28+,29+,30+,31-,32-,33+,34+,35-,36-,38-,39-,40+,41+,42-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12,C42H68O14,pos_2_2sodium,796.460906856,ORESVIJUAVPRJL,Terpenoids,Triterpenoids,Lupane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 6321,2552,-1,,,,0.0,MS1_match,FYLXQAYYBFZLSK-DYMUGMOBSA-N,"InChI=1S/C21H32O11/c1-5-11-12(6-15-29-9(2)10(3)30-15)13(19(26)27-4)8-28-20(11)32-21-18(25)17(24)16(23)14(7-22)31-21/h5,8-12,14-18,20-25H,1,6-7H2,2-4H3/t9-,10+,11-,12-,14+,15-,16+,17-,18+,20-,21-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@H]1O[C@@H](C)[C@@H](C)O1,C21H32O11,pos_1_sodium,460.194461844,FYLXQAYYBFZLSK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6322,2551,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.42150357,ISDB,AQQFWSYLUDMDBP-ODEMIOGVSA-N,"InChI=1S/C28H32O16/c1-40-14-4-9(2-3-10(14)31)13-5-11(32)18-15(41-13)6-12(33)19(22(18)36)26-27(24(38)21(35)16(7-29)42-26)44-28-25(39)23(37)20(34)17(8-30)43-28/h2-6,16-17,20-21,23-31,33-39H,7-8H2,1H3/t16-,17-,20-,21-,23+,24+,25-,26+,27-,28+/m1/s1",COc1cc(-c2cc(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)ccc1O,C28H32O16,,624.169034944,AQQFWSYLUDMDBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Alliaria petiolata,440662.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Thlaspideae'],['Alliaria'],['Alliaria petiolata'],4,3,7.186014294624329 6323,2551,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.42150357,ISDB,AQQFWSYLUDMDBP-ODEMIOGVSA-N,"InChI=1S/C28H32O16/c1-40-14-4-9(2-3-10(14)31)13-5-11(32)18-15(41-13)6-12(33)19(22(18)36)26-27(24(38)21(35)16(7-29)42-26)44-28-25(39)23(37)20(34)17(8-30)43-28/h2-6,16-17,20-21,23-31,33-39H,7-8H2,1H3/t16-,17-,20-,21-,23+,24+,25-,26+,27-,28+/m1/s1",COc1cc(-c2cc(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)ccc1O,C28H32O16,,624.169034944,AQQFWSYLUDMDBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Oryza sativa,709894.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Oryzeae'],['Oryza'],['Oryza sativa'],4,3,7.186014294624329 6324,2551,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.42150357,ISDB,AQQFWSYLUDMDBP-CDOVLSISSA-N,"InChI=1S/C28H32O16/c1-40-14-4-9(2-3-10(14)31)13-5-11(32)18-15(41-13)6-12(33)19(22(18)36)26-27(24(38)21(35)16(7-29)42-26)44-28-25(39)23(37)20(34)17(8-30)43-28/h2-6,16-17,20-21,23-31,33-39H,7-8H2,1H3/t16-,17-,20-,21-,23+,24+,25-,26+,27-,28-/m1/s1",COc1cc(-c2cc(=O)c3c(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3o2)ccc1O,C28H32O16,,624.169034944,AQQFWSYLUDMDBP,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Passiflora incarnata,415784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora incarnata'],4,3,7.186014294624329 6325,2547,556,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.6661478,ISDB,DWGKMGKTDBRQJE-AFHBHXEDSA-N,"InChI=1S/C21H22O7/c1-23-16-5-11(3-4-15(16)22)19-13-8-26-20(14(13)9-25-19)12-6-17(24-2)21-18(7-12)27-10-28-21/h3-7,13-14,19-20,22H,8-10H2,1-2H3/t13-,14-,19+,20+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2cc(OC)c3c(c2)OCO3)ccc1O,C21H22O7,,386.136553044,DWGKMGKTDBRQJE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Nectandra turbacensis,1081324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Nectandra'],['Nectandra turbacensis'],4,3,8.164591312408447 6326,2546,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.5449436,ISDB,OFAYIAUICPXDBC-QPSCCSFWSA-N,"InChI=1S/C15H24O/c1-10(2)12-5-6-15(4)9-13(16)7-11(3)14(15)8-12/h12-14,16H,1,3,5-9H2,2,4H3/t12-,13+,14+,15+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)CC(=C)[C@@H]2C1,C15H24O,,220.182715388,OFAYIAUICPXDBC,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,9.679774284362793 6327,2544,-1,,,,0.38976905,ISDB,,,,,,,SIIIQDOZFLUJLN,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.559076189994812 6328,2543,-1,,,,0.2474123,ISDB,GSCDCVRGFONNJZ-RSWZQJPJSA-N,"InChI=1S/C31H48O4/c1-26(2)21-11-14-31(7)22(29(21,5)13-12-23(26)32)10-9-19-20-17-27(3,25(34)35-8)18-24(33)28(20,4)15-16-30(19,31)6/h9,20-22,24,33H,10-18H2,1-8H3/t20-,21?,22-,24+,27-,28-,29+,30-,31-/m1/s1",COC(=O)[C@]1(C)C[C@@H]2C3=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@@H](O)C1,C31H48O4,,484.355260016,GSCDCVRGFONNJZ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.989649176597595 6329,2543,-1,,,,0.2474123,ISDB,GSCDCVRGFONNJZ-RSWZQJPJSA-N,"InChI=1S/C31H48O4/c1-26(2)21-11-14-31(7)22(29(21,5)13-12-23(26)32)10-9-19-20-17-27(3,25(34)35-8)18-24(33)28(20,4)15-16-30(19,31)6/h9,20-22,24,33H,10-18H2,1-8H3/t20-,21?,22-,24+,27-,28-,29+,30-,31-/m1/s1",COC(=O)[C@]1(C)C[C@@H]2C3=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@@H](O)C1,C31H48O4,,484.355260016,GSCDCVRGFONNJZ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.989649176597595 6330,2540,21,Terpenoids,Steroids,Ergostane steroids,0.4332482,ISDB,,,,,,,SEALMLPNXUIEJE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.7329927682876587 6331,2539,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VMTADHGOTORRMR-STCFVSJZSA-N,"InChI=1S/C24H30O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h7-8,11,18,21-22H,9-10,12H2,1-6H3/t18-,21+,22-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C24H30O10,pos_1_1proton1ammonium,478.18389716,VMTADHGOTORRMR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 6332,2538,888,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,XPMOQRHVZJDUKK-SWZHBTMOSA-N,"InChI=1S/C16H24O8/c1-2-9-10-3-4-21-6-8(10)7-22-15(9)24-16-14(20)13(19)12(18)11(5-17)23-16/h2,7,9-20H,1,3-6H2/t9-,10-,11-,12-,13+,14-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2COCC[C@H]21,C16H24O8,pos_2_1proton1sodium,344.1471177279999,XPMOQRHVZJDUKK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6333,2537,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.69849014,ISDB,,,,,,,IVIAHIHQJAGOAK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.7939605712890625 6334,2536,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,FNYPZWBJPFEVFN-YLCGFITOSA-N,"InChI=1S/C23H29NO10/c1-2-14-15(6-5-13-4-3-7-24(10-13)8-9-25)16(21(30)31)12-32-22(14)34-23-20(29)19(28)18(27)17(11-26)33-23/h2-7,10,12,14-15,17-20,22-23,25-29H,1,8-9,11H2/b6-5+/t14-,15+,17-,18-,19+,20-,22+,23+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCO)c1,C23H29NO10,pos_1_1proton,479.179146128,FNYPZWBJPFEVFN,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 6335,2534,1000,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.25046897,ISDB,FOUFVMIJSDWPJZ-ZZBQETCWSA-N,"InChI=1S/C13H16O7/c14-6-8-9(15)11(10(16)13(18)19-8)20-12(17)7-4-2-1-3-5-7/h1-5,8-11,13-16,18H,6H2/t8-,9-,10-,11+,13-/m1/s1",O=C(O[C@@H]1[C@@H](O)[C@H](O)O[C@H](CO)[C@H]1O)c1ccccc1,C13H16O7,,284.089602852,FOUFVMIJSDWPJZ,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Globularia nudicaulis,27257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Globularieae'],['Globularia'],['Globularia nudicaulis'],4,0,5.001875877380371 6336,2532,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 6337,2532,-1,,,,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1potassium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 6338,2530,9,Terpenoids,Fatty acyls,Fatty aldehydes,0.2754419,ISDB,,,,,,,OSBHHXSYNQKADV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.101767659187317 6339,2527,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.80350894,ISDB,UATOAILWGVYRQS-HHHXNRCGSA-N,"InChI=1S/C28H58NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(31)34-25-27(30)26-36-37(32,33)35-24-23-29(2,3)4/h27,30H,5-26H2,1-4H3/t27-/m1/s1",CCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C28H58NO7P,,551.395089826,UATOAILWGVYRQS,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,5.714035749435425 6340,2527,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.80350894,ISDB,UATOAILWGVYRQS-HHHXNRCGSA-N,"InChI=1S/C28H58NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(31)34-25-27(30)26-36-37(32,33)35-24-23-29(2,3)4/h27,30H,5-26H2,1-4H3/t27-/m1/s1",CCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C28H58NO7P,,551.395089826,UATOAILWGVYRQS,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,5.714035749435425 6341,2523,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,IUCHKMAZAWJNBJ-RCYXVVTDSA-N,"InChI=1S/C36H56O9/c1-31(2)14-16-36(30(42)43)17-15-34(6)19(20(36)18-31)8-9-22-33(5)12-11-23(32(3,4)21(33)10-13-35(22,34)7)44-29-26(39)24(37)25(38)27(45-29)28(40)41/h8,20-27,29,37-39H,9-18H2,1-7H3,(H,40,41)(H,42,43)/t20-,21-,22+,23-,24-,25-,26+,27-,29+,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O9,pos_2_2sodium,632.392433372,IUCHKMAZAWJNBJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],8,0,8.0 6342,2522,-1,,,,0.0,MS1_match,INVGWHRKADIJHF-UHFFFAOYSA-N,"InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1",C[n+]1cc2c3c(ccc2c2ccc4cc5c(cc4c21)OCO5)OCO3,C20H14NO4+,pos_1_sodium,332.09173434809,INVGWHRKADIJHF,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Coptis japonica,387829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis japonica'],6,0,6.0 6343,2520,-1,,,,0.0,MS1_match,IJPILWLAYQFNOD-UQSUZELCSA-N,"InChI=1S/C16H30O10/c1-7(2)3-4-23-16-14(22)12(20)11(19)9(26-16)6-25-15-13(21)10(18)8(17)5-24-15/h7-22H,3-6H2,1-2H3/t8-,9+,10-,11+,12-,13+,14+,15-,16+/m0/s1",CC(C)CCO[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C16H30O10,pos_1_minus1proton2sodium,382.18389715999984,IJPILWLAYQFNOD,,,,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 6344,2520,-1,,,,0.0,MS1_match,XWKAQZKNPBZWNK-RMJHFGBWSA-N,"InChI=1S/C40H45NO17/c1-18-19(2)34(47)56-31-28(46)32(54-22(5)44)39(57-35(48)24-13-10-9-11-14-24)33(55-23(6)45)29(52-20(3)42)26-30(53-21(4)43)40(39,38(31,8)50)58-37(26,7)17-51-36(49)25-15-12-16-41-27(18)25/h9-16,18-19,26,28-33,46,50H,17H2,1-8H3/t18?,19?,26-,28+,29-,30-,31+,32+,33-,37+,38+,39-,40+/m1/s1",CC(=O)O[C@@H]1[C@@H]2[C@@H](OC(C)=O)[C@@]34O[C@@]2(C)COC(=O)c2cccnc2C(C)C(C)C(=O)O[C@@H]([C@H](O)[C@H](OC(C)=O)[C@@]3(OC(=O)c2ccccc2)[C@@H]1OC(C)=O)[C@]4(C)O,C40H45NO17,pos_2_2proton1acetonitrile,811.26874898,XWKAQZKNPBZWNK,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,0,6.0 6345,2519,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.31398684,ISDB,UWYUUTATFZTCJJ-UHFFFAOYSA-N,"InChI=1S/C44H74O12S/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(46)56-40(35-53-44-43(49)42(48)41(47)37(54-44)36-57(50,51)52)55-38(45)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20,22,26,28,37,40-44,47-49H,3-4,6,8-10,12,14-16,19,21,23-25,27,29-36H2,1-2H3,(H,50,51,52)",CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC(COC1OC(CS(=O)(=O)O)C(O)C(O)C1O)OC(=O)CCCCCCCCCCCCCCC,C44H74O12S,,826.490098808,UWYUUTATFZTCJJ,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Porphyra yezoensis,726215.0,['Eukaryota'],['Archaeplastida'],['Rhodophyta'],['Unknown'],['Bangiales'],['Bangiaceae'],['Unknown'],['Pyropia'],['Pyropia yezoensis'],2,0,3.2559473514556885 6346,2516,-1,,,,0.0,MS1_match,GHKISGDRQRSCII-ZOCIIQOWSA-N,"InChI=1S/C20H19NO5/c1-21-7-13-11(2-3-15-20(13)26-9-23-15)18-14(22)4-10-5-16-17(25-8-24-16)6-12(10)19(18)21/h2-3,5-6,14,18-19,22H,4,7-9H2,1H3/t14-,18-,19+/m0/s1",CN1Cc2c(ccc3c2OCO3)[C@@H]2[C@H]1c1cc3c(cc1C[C@@H]2O)OCO3,C20H19NO5,pos_1_sodium,353.126322708,GHKISGDRQRSCII,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 6347,2515,460,Fatty acids,Octadecanoids,Other Octadecanoids,0.3362771,ISDB,LFTUCYCUYUJMJB-UHFFFAOYSA-N,"InChI=1S/C18H28O5/c19-14-10-9-12-17(21)15-16(20)11-7-5-3-1-2-4-6-8-13-18(22)23/h5,7,9,12,15,19,21H,1-4,6,8,10-11,13-14H2,(H,22,23)",O=C(O)CCCCCCCC=CCC(=O)C=C(O)C=CCCO,C18H28O5,,324.193673996,LFTUCYCUYUJMJB,Fatty acids,Octadecanoids,Other Octadecanoids,Cantharellus cibarius,321275.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Cantharellales'],['Cantharellaceae'],['Unknown'],['Cantharellus'],['Cantharellus cibarius'],1,3,3.845108389854431 6348,2515,460,Fatty acids,Octadecanoids,Other Octadecanoids,0.3362771,ISDB,LFTUCYCUYUJMJB-YXCOHMLOSA-N,"InChI=1S/C18H28O5/c19-14-10-9-12-17(21)15-16(20)11-7-5-3-1-2-4-6-8-13-18(22)23/h5,7,9,12,15,19,21H,1-4,6,8,10-11,13-14H2,(H,22,23)/b7-5-,12-9+,17-15-",O=C(O)CCCCCCC/C=C\CC(=O)/C=C(O)/C=C/CCO,C18H28O5,,324.193673996,LFTUCYCUYUJMJB,Fatty acids,Octadecanoids,Other Octadecanoids,Craterellus tubaeformis,183999.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Cantharellales'],['Cantharellaceae'],['Unknown'],['Craterellus'],['Craterellus tubaeformis'],1,3,3.845108389854431 6349,2513,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZWCCPUWSKJGJNH-UHFFFAOYSA-N,"InChI=1S/C32H50O13/c1-17(2)10-24(34)42-16-32(39)23(43-21(9)33)13-31(38)22(15-41-30(28(31)32)45-26(36)12-19(5)6)14-40-29(37)27(20(7)8)44-25(35)11-18(3)4/h15,17-20,23,27-28,30,38-39H,10-14,16H2,1-9H3",CC(=O)OC1CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C2C1(O)COC(=O)CC(C)C,C32H50O13,pos_2_2sodium,642.32514166,ZWCCPUWSKJGJNH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6350,2513,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZWCCPUWSKJGJNH-GIBMAKMFSA-N,"InChI=1S/C32H50O13/c1-17(2)10-24(34)42-16-32(39)23(43-21(9)33)13-31(38)22(15-41-30(28(31)32)45-26(36)12-19(5)6)14-40-29(37)27(20(7)8)44-25(35)11-18(3)4/h15,17-20,23,27-28,30,38-39H,10-14,16H2,1-9H3/t23-,27+,28-,30-,31-,32+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)C,C32H50O13,pos_2_2sodium,642.32514166,ZWCCPUWSKJGJNH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 6351,2513,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZWCCPUWSKJGJNH-ZTJXRXMQSA-N,"InChI=1S/C32H50O13/c1-17(2)10-24(34)42-16-32(39)23(43-21(9)33)13-31(38)22(15-41-30(28(31)32)45-26(36)12-19(5)6)14-40-29(37)27(20(7)8)44-25(35)11-18(3)4/h15,17-20,23,27-28,30,38-39H,10-14,16H2,1-9H3/t23-,27?,28-,30-,31-,32+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)C,C32H50O13,pos_2_2sodium,642.32514166,ZWCCPUWSKJGJNH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 6352,2511,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.21589668,ISDB,BPMFQXXZWSBLRP-UHFFFAOYSA-N,"InChI=1S/C12H18O/c1-9-5-11(6-10(2)13)8-12(3,4)7-9/h5-6H,7-8H2,1-4H3",CC(=O)C=C1C=C(C)CC(C)(C)C1,C12H18O,,178.135765196,BPMFQXXZWSBLRP,Terpenoids,Monoterpenoids,,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,2,5.863586723804474 6353,2510,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.74246013,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,1,7.4698405265808105 6354,2508,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.5429327,ISDB,RIYORZPRGANLCW-UHFFFAOYSA-N,"InChI=1S/C17H19NO4/c19-14-5-1-12(2-6-14)9-10-18-17(22)8-4-13-3-7-15(20)16(21)11-13/h1-3,5-7,11,19-21H,4,8-10H2,(H,18,22)",O=C(CCc1ccc(O)c(O)c1)NCCc1ccc(O)cc1,C17H19NO4,,301.131408088,RIYORZPRGANLCW,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Lycium chinense,58730.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Lycieae'],['Lycium'],['Lycium chinense'],4,3,7.6717307567596436 6355,2507,508,Terpenoids,Monoterpenoids,Pyranocoumarins,0.0,MS1_match,MUPAOXGYJYRUDB-LBPRGKRZSA-N,"InChI=1S/C15H16O4/c1-15(2)12(17-3)8-10-11(19-15)6-4-9-5-7-13(16)18-14(9)10/h4-7,12H,8H2,1-3H3/t12-/m0/s1",CO[C@H]1Cc2c(ccc3ccc(=O)oc23)OC1(C)C,C15H16O4,pos_1_1proton1ammonium,260.104858992,MUPAOXGYJYRUDB,Shikimates and Phenylpropanoids,Coumarins,Pyranocoumarins,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6356,2507,508,Terpenoids,Monoterpenoids,Pyranocoumarins,0.0,MS1_match,MUPAOXGYJYRUDB-LBPRGKRZSA-N,"InChI=1S/C15H16O4/c1-15(2)12(17-3)8-10-11(19-15)6-4-9-5-7-13(16)18-14(9)10/h4-7,12H,8H2,1-3H3/t12-/m0/s1",CO[C@H]1Cc2c(ccc3ccc(=O)oc23)OC1(C)C,C15H16O4,pos_1_1proton1ammonium,260.104858992,MUPAOXGYJYRUDB,Shikimates and Phenylpropanoids,Coumarins,Pyranocoumarins,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 6357,2501,-1,,,,0.2367384,ISDB,GVJHHUAWPYXKBD-IHMCZWCLSA-N,"InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29+/m0/s1",Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)O2,C29H50O2,,430.3810808399999,GVJHHUAWPYXKBD,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Argemone mexicana,408476.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Argemone'],['Argemone mexicana'],5,0,5.946953594684601 6358,2494,-1,,,,0.40392733,ISDB,WEHZDNHJZBEGME-GTQRNPCRSA-N,"InChI=1S/C16H28O7/c1-4-16(3,21)7-5-6-10(2)9-22-15-14(20)13(19)12(18)11(8-17)23-15/h4,6,11-15,17-21H,1,5,7-9H2,2-3H3/b10-6+/t11-,12-,13+,14-,15-,16?/m1/s1",C=CC(C)(O)CC/C=C(\C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O7,,332.1835032359999,WEHZDNHJZBEGME,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Viburnum orientale,296902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum orientale'],5,0,6.61570930480957 6359,2494,-1,,,,0.40392733,ISDB,WEHZDNHJZBEGME-PAHMEIBGSA-N,"InChI=1S/C16H28O7/c1-4-16(3,21)7-5-6-10(2)9-22-15-14(20)13(19)12(18)11(8-17)23-15/h4,6,11-15,17-21H,1,5,7-9H2,2-3H3/b10-6+/t11-,12-,13+,14-,15-,16+/m1/s1",C=C[C@](C)(O)CC/C=C(\C)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H28O7,,332.1835032359999,WEHZDNHJZBEGME,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Viburnum lantana,572547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum lantana'],5,0,6.61570930480957 6360,2487,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 6361,2487,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 6362,2487,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6363,2487,834,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6364,2485,672,Polyketides,Chromanes,Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_sodium,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 6365,2485,672,Polyketides,Chromanes,Chromones,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_sodium,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 6366,2485,672,Polyketides,Chromanes,Chromones,0.0,MS1_match,PBHOYFHVNTVOLB-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(8-30-21-19(29)18(28)17(27)15(7-23)32-21)2-3-11-12(24)5-14(26)16-13(25)4-10(6-22)31-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O11,pos_1_sodium,454.147511652,PBHOYFHVNTVOLB,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 6367,2485,672,Polyketides,Chromanes,Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_sodium,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,3,7.5 6368,2485,672,Polyketides,Chromanes,Chromones,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_sodium,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 6369,2482,-1,,,,0.0,MS1_match,BJIOGJUNALELMI-ONEGZZNKSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+",C/C=C/c1ccc(O)c(OC)c1,C10H12O2,pos_2MNa,164.083729624,BJIOGJUNALELMI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 6370,2482,-1,,,,0.0,MS1_match,BJIOGJUNALELMI-ONEGZZNKSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+",C/C=C/c1ccc(O)c(OC)c1,C10H12O2,pos_2MNa,164.083729624,BJIOGJUNALELMI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 6371,2482,-1,,,,0.0,MS1_match,KEQHJBNSCLWCAE-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6H,1-3H3",CC1=CC(=O)C(C(C)C)=CC1=O,C10H12O2,pos_2MNa,164.083729624,KEQHJBNSCLWCAE,Terpenoids,,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 6372,2482,-1,,,,0.0,MS1_match,KEQHJBNSCLWCAE-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6H,1-3H3",CC1=CC(=O)C(C(C)C)=CC1=O,C10H12O2,pos_2MNa,164.083729624,KEQHJBNSCLWCAE,Terpenoids,,,Ranunculaceae,387826.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Unknown'],['Unknown'],6,0,6.0 6373,2482,-1,,,,0.0,MS1_match,FPRGRROJPRIHJP-UHFFFAOYSA-N,"InChI=1S/C20H24O4/c1-9(2)11-7-13(21)19(5)17(15(11)23)20(6)14(22)8-12(10(3)4)16(24)18(19)20/h7-10,17-18H,1-6H3",CC(C)C1=CC(=O)C2(C)C(C1=O)C1(C)C(=O)C=C(C(C)C)C(=O)C21,C20H24O4,pos_1_sodium,328.167459248,FPRGRROJPRIHJP,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 6374,2480,303,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,AOCLIMDHBMBYGD-NQWMYEDTSA-N,"InChI=1S/C16H28O2/c1-10-8-12(17)13-15(10,4)9-11-6-7-16(13,5)18-14(11,2)3/h10-13,17H,6-9H2,1-5H3/t10-,11-,12-,13-,15-,16+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@]1(C)C[C@H]1CC[C@]2(C)OC1(C)C,C16H28O2,pos_2_1proton1sodium,252.208930136,AOCLIMDHBMBYGD,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6375,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Illigera luzonensis,730771.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Illigera'],['Illigera luzonensis'],4,3,8.2926926612854 6376,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Mitrephora thorelii,5700180.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Mitrephora'],['Mitrephora thorelii'],4,3,8.2926926612854 6377,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Mitrephora tomentosa,3867458.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Mitrephora'],['Mitrephora tomentosa'],4,3,8.2926926612854 6378,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Polyalthia longifolia,204189.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Monoon'],['Monoon longifolium'],4,3,8.2926926612854 6379,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.2926926612854 6380,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Peperomia heyneana,6029503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Peperomia'],['Peperomia heyneana'],4,3,8.2926926612854 6381,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Lindera glauca,157205.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Lindera'],['Lindera glauca'],4,3,8.2926926612854 6382,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,8.2926926612854 6383,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Litsea hypophaea,559683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Litsea'],['Litsea hypophaea'],4,3,8.2926926612854 6384,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Porcelia macrocarpa,3867661.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Bocageeae'],['Porcelia'],['Porcelia macrocarpa'],4,3,8.2926926612854 6385,2478,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.69817317,ISDB,IEDBNTAKVGBZEP-VMPITWQZSA-N,"InChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+",COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)cc(OC)c1O,C19H21NO5,,343.141972772,IEDBNTAKVGBZEP,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Raphanus sativus,359073.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Raphanus'],['Raphanus sativus'],4,3,8.2926926612854 6386,2474,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,BSOROLZKYXGRJC-LVXXQJFHSA-N,"InChI=1S/C23H34N2O3/c1-4-21-10-16(28-3)23-13-8-12-6-7-22(27,18(13)17(12)20(24)26)14(9-15(21)23)19(23)25(5-2)11-21/h4,12-19,27H,1,5-11H2,2-3H3,(H2,24,26)/t12?,13?,14?,15?,16-,17?,18?,19?,21+,22-,23?/m0/s1",C=C[C@]12C[C@H](OC)C34C5CC6CC[C@](O)(C(CC31)C4N(CC)C2)C5C6C(N)=O,C23H34N2O3,pos_2MH,386.256942948,BSOROLZKYXGRJC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 6387,2468,-1,,,,0.0,MS1_match,DANYIYRPLHHOCZ-UHFFFAOYSA-N,"InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,C16H12O5,pos_1_1proton1isopropanol,284.068473484,DANYIYRPLHHOCZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,0,6.0 6388,2468,-1,,,,0.0,MS1_match,DANYIYRPLHHOCZ-UHFFFAOYSA-N,"InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,C16H12O5,pos_1_1proton1isopropanol,284.068473484,DANYIYRPLHHOCZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,0,6.0 6389,2468,-1,,,,0.0,MS1_match,DANYIYRPLHHOCZ-UHFFFAOYSA-N,"InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,C16H12O5,pos_1_1proton1isopropanol,284.068473484,DANYIYRPLHHOCZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,0,6.0 6390,2468,-1,,,,0.0,MS1_match,DANYIYRPLHHOCZ-UHFFFAOYSA-N,"InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,C16H12O5,pos_1_1proton1isopropanol,284.068473484,DANYIYRPLHHOCZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana ficariifolia,5746450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana ficariifolia'],6,0,6.0 6391,2468,-1,,,,0.0,MS1_match,DANYIYRPLHHOCZ-UHFFFAOYSA-N,"InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1,C16H12O5,pos_1_1proton1isopropanol,284.068473484,DANYIYRPLHHOCZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,0,6.0 6392,2468,-1,,,,0.0,MS1_match,ZLGRXDWWYMFIGI-UHFFFAOYSA-N,"InChI=1S/C16H12O5/c1-8-11(18)6-14-15(16(8)20)12(19)7-13(21-14)9-2-4-10(17)5-3-9/h2-7,17-18,20H,1H3",Cc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O,C16H12O5,pos_1_1proton1isopropanol,284.068473484,ZLGRXDWWYMFIGI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6393,2468,-1,,,,0.0,MS1_match,ZLGRXDWWYMFIGI-UHFFFAOYSA-N,"InChI=1S/C16H12O5/c1-8-11(18)6-14-15(16(8)20)12(19)7-13(21-14)9-2-4-10(17)5-3-9/h2-7,17-18,20H,1H3",Cc1c(O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O,C16H12O5,pos_1_1proton1isopropanol,284.068473484,ZLGRXDWWYMFIGI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 6394,2466,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.65270907,ISDB,IHEBZQKYPSMVBZ-UHFFFAOYSA-N,"InChI=1S/C10H8O2/c1-7-5-12-6-10-8(4-11)2-3-9(7)10/h2-6H,1H3",Cc1cocc2c(C=O)ccc1-2,C10H8O2,,160.052429496,IHEBZQKYPSMVBZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Viburnum tinus,51742.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum tinus'],5,0,7.6108362674713135 6395,2466,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.65270907,ISDB,IHEBZQKYPSMVBZ-UHFFFAOYSA-N,"InChI=1S/C10H8O2/c1-7-5-12-6-10-8(4-11)2-3-9(7)10/h2-6H,1H3",Cc1cocc2c(C=O)ccc1-2,C10H8O2,,160.052429496,IHEBZQKYPSMVBZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Viburnum opulus,117453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum opulus'],5,0,7.6108362674713135 6396,2462,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.27931505,ISDB,JNSPPTHCEKIBMW-UHFFFAOYSA-N,"InChI=1S/C16H13NO3/c1-20-15-13(10-6-3-2-4-7-10)11-8-5-9-12(18)14(11)17-16(15)19/h2-9,18H,1H3,(H,17,19)",COc1c(O)nc2c(O)cccc2c1-c1ccccc1,C16H13NO3,,267.089543276,JNSPPTHCEKIBMW,Alkaloids,,,Aspergillus versicolor,534823.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus versicolor'],1,1,2.617260217666626 6397,2461,-1,,,,0.0,MS1_match,VINQZMMOIPTITQ-QWYWWIDCSA-N,"InChI=1S/C48H78O18/c1-22-38(66-41-36(57)33(54)31(52)26(64-41)20-61-39-35(56)32(53)30(51)25(19-49)63-39)34(55)37(58)40(62-22)65-29-11-12-44(4)27(45(29,5)21-50)10-13-47(7)28(44)9-8-23-24-18-43(2,3)14-16-48(24,42(59)60)17-15-46(23,47)6/h8,22,24-41,49-58H,9-21H2,1-7H3,(H,59,60)/t22-,24-,25+,26+,27+,28+,29-,30+,31+,32-,33-,34-,35+,36+,37+,38-,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@]5(C(=O)O)CC[C@]34C)[C@]2(C)CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_2_1proton1potassium,942.518815656,VINQZMMOIPTITQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Cephalaria transsylvanica,3892197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria transsylvanica'],6,0,6.0 6398,2460,344,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Chromones,0.6080118,ISDB,NRXBNSBNWUANMF-WMASDFALSA-N,"InChI=1S/C24H22O12/c25-13-5-1-11(9-14(13)26)2-7-17(27)33-10-16-19(29)21(31)22(32)24(35-16)34-15-6-3-12-4-8-18(28)36-23(12)20(15)30/h1-9,16,19,21-22,24-26,29-32H,10H2/b7-2+/t16-,19-,21+,22-,24-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2ccc3ccc(=O)oc3c2O)[C@H](O)[C@@H](O)[C@@H]1O,C24H22O12,,502.111126144,NRXBNSBNWUANMF,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Cruciata taurica,221990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Cruciata'],['Cruciata taurica'],4,1,6.932047128677368 6399,2456,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.5964673,ISDB,YURWZDJEVHQYGV-DOJUMQAQSA-N,"InChI=1S/C19H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(21)22-2/h10-11,18,20H,3-9,12-17H2,1-2H3/b11-10+/t18-/m1/s1",CCCCCCCC/C=C/CCCCCC[C@@H](O)C(=O)OC,C19H36O3,,312.266445012,YURWZDJEVHQYGV,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Salvia nilotica,861976.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia nilotica'],4,3,7.885869264602661 6400,2455,-1,,,,0.0,MS1_match,KKLONPANWKAOPP-DFEUVTCYSA-N,"InChI=1S/C24H29NO11/c1-3-14-15(6-5-12-7-13(21(30)31)9-25(4-2)8-12)16(22(32)33)11-34-23(14)36-24-20(29)19(28)18(27)17(10-26)35-24/h3,5-9,11,14-15,17-20,23-24,26-29H,1,4,10H2,2H3,(H-,30,31,32,33)/b6-5+/t14-,15+,17-,18-,19+,20-,23+,24+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1cc(C(=O)O)c[n+](CC)c1,C24H29NO11,pos_1_1proton1methanol,507.1740607479998,KKLONPANWKAOPP,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6401,2455,-1,,,,0.0,MS1_match,ONSYQRQUUDJRLS-IRTUFKDUSA-N,"InChI=1S/C24H29NO11/c1-2-14-15(6-5-13-4-3-8-25(10-13)9-7-18(27)28)16(22(32)33)12-34-23(14)36-24-21(31)20(30)19(29)17(11-26)35-24/h2-6,8,10,12,14-15,17,19-21,23-24,26,29-31H,1,7,9,11H2,(H-,27,28,32,33)/b6-5+/t14-,15+,17-,19-,20+,21-,23+,24+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCC(=O)O)c1,C24H29NO11,pos_1_1proton1methanol,507.1740607479998,ONSYQRQUUDJRLS,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6402,2455,-1,,,,0.0,MS1_match,YEXJLSCDDBIEPB-DFEUVTCYSA-N,"InChI=1S/C24H29NO11/c1-4-14-15(6-5-12-7-13(21(30)31)9-25(2)8-12)16(22(32)33-3)11-34-23(14)36-24-20(29)19(28)18(27)17(10-26)35-24/h4-9,11,14-15,17-20,23-24,26-29H,1,10H2,2-3H3/b6-5+/t14-,15+,17-,18-,19+,20-,23+,24+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)[O-])c[n+](C)c1,C24H29NO11,pos_1_1proton1methanol,507.174060748,YEXJLSCDDBIEPB,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6403,2453,-1,,,,0.7072709,ISDB,JAWNWMYMRGNVMQ-GVFKUQRYSA-N,"InChI=1S/C31H28O14/c1-41-23-9-15(4-6-19(23)34)30-24(12-17-20(35)10-16(32)11-22(17)43-30)44-31-29(40)28(39)27(38)25(45-31)13-42-26(37)7-3-14-2-5-18(33)21(36)8-14/h2-12,25,27-29,31-34,36,38-40H,13H2,1H3/t25-,27-,28+,29-,31-/m1/s1",COc1cc(-c2oc3cc(O)cc(=O)c-3cc2O[C@@H]2O[C@H](COC(=O)C=Cc3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C31H28O14,,624.147905576,JAWNWMYMRGNVMQ,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Vitis cinerea,314458.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis cinerea'],4,0,6.829083681106567 6404,2453,-1,,,,0.7072709,ISDB,JAWNWMYMRGNVMQ-GVFKUQRYSA-N,"InChI=1S/C31H28O14/c1-41-23-9-15(4-6-19(23)34)30-24(12-17-20(35)10-16(32)11-22(17)43-30)44-31-29(40)28(39)27(38)25(45-31)13-42-26(37)7-3-14-2-5-18(33)21(36)8-14/h2-12,25,27-29,31-34,36,38-40H,13H2,1H3/t25-,27-,28+,29-,31-/m1/s1",COc1cc(-c2oc3cc(O)cc(=O)c-3cc2O[C@@H]2O[C@H](COC(=O)C=Cc3ccc(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C31H28O14,,624.147905576,JAWNWMYMRGNVMQ,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,0,6.829083681106567 6405,2450,-1,,,,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1potassium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6406,2450,-1,,,,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1potassium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6407,2450,-1,,,,0.0,MS1_match,QNDLGCSMZUBKMI-ASTYLPHCSA-N,"InChI=1S/C26H34O12/c1-14(27)32-11-17-12-33-23(36-21(31)10-25(6,7)38-16(3)29)22-18(17)8-19(26(22)13-34-26)35-20(30)9-24(4,5)37-15(2)28/h8,12,19,22-23H,9-11,13H2,1-7H3/t19-,22+,23-,26+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)(C)OC(C)=O)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C26H34O12,pos_1_1potassium,538.205026528,QNDLGCSMZUBKMI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,0,6.0 6408,2450,-1,,,,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_1potassium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6409,2450,-1,,,,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_1potassium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6410,2450,-1,,,,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1potassium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6411,2450,-1,,,,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1potassium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6412,2448,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QJVXKWHHAMZTBY-GCPOEHJPSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3+/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C/CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_1proton1acetonitrile,372.142032348,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 6413,2448,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QJVXKWHHAMZTBY-GCPOEHJPSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3+/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C/CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_1proton1acetonitrile,372.142032348,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 6414,2444,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.23603378,ISDB,YULTUTUKMKNZHP-NVTQBHAOSA-N,"InChI=1S/C17H24O7/c1-9(18)5-3-2-4-6-11-7-10-8-12(19)14(16(21)22)15(20)13(10)17(23)24-11/h8-9,11,17-20,23H,2-7H2,1H3,(H,21,22)/t9-,11+,17+/m1/s1",C[C@@H](O)CCCCC[C@H]1Cc2cc(O)c(C(=O)O)c(O)c2[C@@H](O)O1,C17H24O7,,340.152203108,YULTUTUKMKNZHP,Polyketides,Chromanes,Azaphilones,Penicillium corylophilum,724251.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium corylophilum'],1,0,1.9441351294517517 6415,2443,380,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,0.2785375,ISDB,KQQJHYGPRJWZEY-LDICSKNTSA-N,"InChI=1S/C14H18O4/c1-7-6-12-11(8(2)14(17)18-12)5-4-10(7)13(16)9(3)15/h4,7,11-13,16H,2,5-6H2,1,3H3/t7-,11+,12+,13-/m0/s1",C=C1C(=O)O[C@@H]2C[C@H](C)C([C@@H](O)C(C)=O)=CC[C@H]12,C14H18O4,,250.120509056,KQQJHYGPRJWZEY,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,Dittrichia graveolens,3899100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Dittrichia'],['Dittrichia graveolens'],4,3,6.614150047302246 6416,2442,559,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.83459926,ISDB,HAIPHKFLSXSDAN-BLOCXYQCSA-N,"InChI=1S/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,31,33,42H,6-7,9,11-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H76NO8P,,777.530855022,HAIPHKFLSXSDAN,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,5.838397026062012 6417,2442,559,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.83459926,ISDB,HAIPHKFLSXSDAN-BLOCXYQCSA-N,"InChI=1S/C44H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h8,10,14,16,19-20,22-23,25,27,31,33,42H,6-7,9,11-13,15,17-18,21,24,26,28-30,32,34-41H2,1-5H3/b10-8-,16-14-,20-19-,23-22-,27-25-,33-31-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C44H76NO8P,,777.530855022,HAIPHKFLSXSDAN,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,5.838397026062012 6418,2438,-1,,,,0.0,MS1_match,DRLFMBDRBRZALE-UHFFFAOYSA-N,"InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)",COc1ccc2[nH]cc(CCNC(C)=O)c2c1,C13H16N2O2,pos_1_1proton1ethylamine,232.121177752,DRLFMBDRBRZALE,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6419,2432,-1,,,,0.44462508,ISDB,AHBFIAOFVNMQGM-RGLDJICNSA-N,"InChI=1S/C18H30O8/c1-17(24)6-4-3-5-9-12(17)10(20)7-18(9,2)26-16-15(23)14(22)13(21)11(8-19)25-16/h3,5,9-16,19-24H,4,6-8H2,1-2H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-/m0/s1",C[C@@]1(O)CCC=C[C@H]2[C@H]1[C@@H](O)C[C@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C18H30O8,,374.19406791999984,AHBFIAOFVNMQGM,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dictamnus dasycarpus,651514.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Dictamnus'],['Dictamnus dasycarpus'],4,0,5.778500318527222 6420,2431,1629,Terpenoids,Sesquiterpenoids,Other Octadecanoids,0.41636246,ISDB,WTLVYAWQAPUBFY-UTLPMFLDSA-N,"InChI=1S/C18H28O4/c1-2-3-4-6-11-16(19)13-9-10-14-17(20)12-7-5-8-15-18(21)22/h9-10,13-14H,2-8,11-12,15H2,1H3,(H,21,22)/b13-9+,14-10+",CCCCCCC(=O)/C=C/C=C/C(=O)CCCCCC(=O)O,C18H28O4,,308.198759376,WTLVYAWQAPUBFY,Fatty acids,Octadecanoids,Other Octadecanoids,Ostodes paniculata,1028448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Codiaeae'],['Ostodes'],['Ostodes paniculata'],4,3,7.165449857711792 6421,2430,494,Alkaloids,Peptide alkaloids,Simple amide alkaloids,0.5204491,ISDB,ZOKXIFXOULCJPE-SAUXFKQKSA-N,"InChI=1S/C13H23NO2/c1-5-7-8-11(4)13(16)14-12(9-15)10(3)6-2/h5,7-8,10,12,15H,6,9H2,1-4H3,(H,14,16)/b7-5+,11-8+/t10-,12-/m0/s1",C/C=C/C=C(\C)C(=O)N[C@@H](CO)[C@@H](C)CC,C13H23NO2,,225.172878976,ZOKXIFXOULCJPE,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Acremonium furcatum,871254.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Bionectriaceae'],['Unknown'],['Acremonium'],['Acremonium furcatum'],1,3,4.581796407699585 6422,2429,809,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,UPJVQRZPXLZUET-KGHQQZOUSA-N,"InChI=1S/C28H46O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26,30)15-16-28(23,24)31/h7-8,15-16,18-24,29-31H,9-14,17H2,1-6H3/b8-7+/t19-,20+,21-,22+,23+,24+,25+,26+,27+,28-/m0/s1",CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@]3(O)C=C[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H46O3,pos_1_1proton1methanol,430.344695332,UPJVQRZPXLZUET,Terpenoids,Steroids,Cholestane steroids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 6423,2421,753,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5283866,ISDB,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,10.613546371459961 6424,2421,753,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5283866,ISDB,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,3,10.613546371459961 6425,2420,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1proton1methanol,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 6426,2420,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.0,MS1_match,QZCJFXSHMSZCLH-UHFFFAOYSA-N,"InChI=1S/C17H24O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9,11-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(=O)CC12,C17H24O11,pos_1_1proton1methanol,404.131861588,QZCJFXSHMSZCLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 6427,2420,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.0,MS1_match,PIJWCPNNZULZBH-GRYWMYPUSA-N,"InChI=1S/C18H28O12/c1-7(20)12-8(4-11(21)26-2)9(16(25)27-3)6-28-17(12)30-18-15(24)14(23)13(22)10(5-19)29-18/h6-8,10,12-15,17-20,22-24H,4-5H2,1-3H3/t7-,8+,10+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C[C@@H]1C(C(=O)OC)=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1[C@H](C)O,C18H28O12,pos_1_1proton,436.158076336,PIJWCPNNZULZBH,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 6428,2417,583,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.0,MS1_match,XRKBRPFTFKKHEF-DGDBGZAXSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1",COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C17H22O10,pos_1_1proton1isopropanol,386.1212969039999,XRKBRPFTFKKHEF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,0,6.0 6429,2417,583,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.0,MS1_match,KKLWTTVTWMTNBP-KYXYLJOWSA-N,"InChI=1S/C17H22O10/c1-24-9-5-8(3-4-12(19)20)6-10(25-2)16(9)27-17-15(23)14(22)13(21)11(7-18)26-17/h3-6,11,13-15,17-18,21-23H,7H2,1-2H3,(H,19,20)/b4-3+/t11-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C/C(=O)O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H22O10,pos_1_1proton1isopropanol,386.1212969039999,KKLWTTVTWMTNBP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 6430,2417,583,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.0,MS1_match,QWIIMHNSFMCFHE-IWHNWRMISA-N,"InChI=1S/C17H22O10/c1-26-11-5-8(6-12(27-2)15(11)23)3-4-9(19)13(21)16(24)17(25)14(22)10(20)7-18/h3-6,10,14,16-18,20,22-25H,7H2,1-2H3/b4-3+/t10-,14-,16+,17+/m1/s1",COc1cc(/C=C/C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)cc(OC)c1O,C17H22O10,pos_1_1proton1isopropanol,386.121296904,QWIIMHNSFMCFHE,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,0,6.0 6431,2415,-1,,,,0.3507229,ISDB,ZLDYUMOPQLDZRB-XAGHOVOHSA-N,"InChI=1S/C15H26O5/c1-11(5-4-6-12(2)9-14(18)19)7-8-13(17)15(3,20)10-16/h5,9,13,16-17,20H,4,6-8,10H2,1-3H3,(H,18,19)/b11-5+,12-9-",C/C(=C/C(=O)O)CC/C=C(\C)CCC(O)C(C)(O)CO,C15H26O5,,286.178023932,ZLDYUMOPQLDZRB,Terpenoids,Monoterpenoids,,Aspergillus,550772.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Unknown'],1,0,2.4028916358947754 6432,2413,-1,,,,0.44715533,ISDB,AFZHQMQGUKDWSJ-CCNHJUIBSA-N,"InChI=1S/C38H66O2/c1-10-11-12-13-14-20-35(39)40-27-16-19-33-31(29(4)5)21-22-34-36(33,7)25-26-37(8)32(23-24-38(34,37)9)30(6)18-15-17-28(2)3/h17,30,32-34H,10-16,18-27H2,1-9H3/t30-,32-,33+,34-,36+,37-,38+/m0/s1",CCCCCCCC(=O)OCCC[C@@H]1C(=C(C)C)CC[C@H]2[C@]1(C)CC[C@@]1(C)[C@H]([C@@H](C)CCC=C(C)C)CC[C@]21C,C38H66O2,,554.506281352,AFZHQMQGUKDWSJ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Helianthus annuus,515712.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Helianthus'],['Helianthus annuus'],4,0,5.788621306419373 6433,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Oryza sativa,709894.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Oryzeae'],['Oryza'],['Oryza sativa'],4,0,5.60517144203186 6434,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Glycyrrhiza glabra,554264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza glabra'],4,0,5.60517144203186 6435,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Ononis repens,1047599.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis repens'],4,0,5.60517144203186 6436,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BAHRDPFUSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11?,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(\C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Pyrus communis,972654.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Pyrus'],['Pyrus communis'],4,0,5.60517144203186 6437,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Mangifera indica,807634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Mangifera'],['Mangifera indica'],4,0,5.60517144203186 6438,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Prunus persica,259054.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus persica'],4,0,5.60517144203186 6439,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Prunus armeniaca,217632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus armeniaca'],4,0,5.60517144203186 6440,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Cucumis melo,1006256.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Benincaseae'],['Cucumis'],['Cucumis melo'],4,0,5.60517144203186 6441,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Citrus paradisi,3942423.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus aurantium'],4,0,5.60517144203186 6442,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BAHRDPFUSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11?,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(\C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,0,5.60517144203186 6443,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Olea europaea,23729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Oleeae'],['Olea'],['Olea europaea'],4,0,5.60517144203186 6444,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,0,5.60517144203186 6445,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BHLJUDRVSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11-,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C\C=C(/C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,0,5.60517144203186 6446,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Hibiscus syriacus,930407.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Hibiscus'],['Hibiscus syriacus'],4,0,5.60517144203186 6447,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,0,5.60517144203186 6448,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-UHFFFAOYSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Crocus sativus,542824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Iridaceae'],['Croceae'],['Crocus'],['Crocus sativus'],4,0,5.60517144203186 6449,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BAHRDPFUSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11?,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(\C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Dracaena draco,107686.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Dracaena'],['Dracaena draco'],4,0,5.60517144203186 6450,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BAHRDPFUSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11?,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(\C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Diospyros kaki,352883.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ebenaceae'],['Unknown'],['Diospyros'],['Diospyros kaki'],4,0,5.60517144203186 6451,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BAHRDPFUSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11?,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(\C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],4,0,5.60517144203186 6452,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BAHRDPFUSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11?,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(\C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Rosa villosa,1091505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa villosa'],4,0,5.60517144203186 6453,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Pisum sativum,359905.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Pisum'],['Pisum sativum'],4,0,5.60517144203186 6454,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-UHFFFAOYSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Passiflora edulis,183517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora edulis'],4,0,5.60517144203186 6455,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Zea mays,605194.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Andropogoneae'],['Zea'],['Zea mays'],4,0,5.60517144203186 6456,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-KEKOKYSKSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Dovyalis,196514.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Flacourtieae'],['Dovyalis'],['Unknown'],4,0,5.60517144203186 6457,2410,-1,,,,0.40129286,ISDB,YVLPJIGOMTXXLP-BAHRDPFUSA-N,"InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11?,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC=C/C=C(\C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H64,,544.500802048,YVLPJIGOMTXXLP,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Rosa pomifera,1091505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rosa'],['Rosa villosa'],4,0,5.60517144203186 6458,2408,-1,,,,0.0,MS1_match,FKARAOWYAAUAFW-MGRBCSRPSA-N,"InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20+,21-,24-,25+,26-,27-,28+/m1/s1",Cc1c(O)c(O)cc2c1CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H40O4,pos_2_2sodium,440.29265976,FKARAOWYAAUAFW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 6459,2408,-1,,,,0.0,MS1_match,FKARAOWYAAUAFW-MGRBCSRPSA-N,"InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20+,21-,24-,25+,26-,27-,28+/m1/s1",Cc1c(O)c(O)cc2c1CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@H](C)C(=O)[C@@H](O)[C@]3(C)CC[C@]12C,C28H40O4,pos_2_2sodium,440.29265976,FKARAOWYAAUAFW,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 6460,2407,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.29385275,ISDB,XFXPKEVQMIUIEY-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-11(14)7-10(16-3)8-5-4-6-9(15-2)12(8)13/h4-7H,1-3H3",COc1cc(=O)n(C)c2c(OC)cccc12,C12H13NO3,,219.089543276,XFXPKEVQMIUIEY,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum obtusifolium,762592.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum obtusifolium'],4,3,6.675410985946655 6461,2407,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.29385275,ISDB,XFXPKEVQMIUIEY-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-11(14)7-10(16-3)8-5-4-6-9(15-2)12(8)13/h4-7H,1-3H3",COc1cc(=O)n(C)c2c(OC)cccc12,C12H13NO3,,219.089543276,XFXPKEVQMIUIEY,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Boronia pinnata,5747713.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Boronia'],['Boronia pinnata'],4,3,6.675410985946655 6462,2407,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.29385275,ISDB,XFXPKEVQMIUIEY-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-11(14)7-10(16-3)8-5-4-6-9(15-2)12(8)13/h4-7H,1-3H3",COc1cc(=O)n(C)c2c(OC)cccc12,C12H13NO3,,219.089543276,XFXPKEVQMIUIEY,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum griffithianum,520170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum griffithianum'],4,3,6.675410985946655 6463,2407,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.29385275,ISDB,XFXPKEVQMIUIEY-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-11(14)7-10(16-3)8-5-4-6-9(15-2)12(8)13/h4-7H,1-3H3",COc1cc(=O)n(C)c2c(OC)cccc12,C12H13NO3,,219.089543276,XFXPKEVQMIUIEY,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Almeidea rubra,5747580.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Almeidea'],['Almeidea rubra'],4,3,6.675410985946655 6464,2407,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.29385275,ISDB,XFXPKEVQMIUIEY-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-11(14)7-10(16-3)8-5-4-6-9(15-2)12(8)13/h4-7H,1-3H3",COc1cc(=O)n(C)c2c(OC)cccc12,C12H13NO3,,219.089543276,XFXPKEVQMIUIEY,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum bungei,762610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum bungei'],4,3,6.675410985946655 6465,2407,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.29385275,ISDB,XFXPKEVQMIUIEY-UHFFFAOYSA-N,"InChI=1S/C12H13NO3/c1-13-11(14)7-10(16-3)8-5-4-6-9(15-2)12(8)13/h4-7H,1-3H3",COc1cc(=O)n(C)c2c(OC)cccc12,C12H13NO3,,219.089543276,XFXPKEVQMIUIEY,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,Haplophyllum dauricum,762604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum dauricum'],4,3,6.675410985946655 6466,2405,-1,,,,0.84195065,ISDB,IWRZCJCFXSVREX-INIZCTEOSA-N,"InChI=1S/C18H19NO3/c1-22-18-8-11-4-5-19-10-12-2-3-14(20)6-13(12)7-16(19)15(11)9-17(18)21/h2-3,6,8-9,16,20-21H,4-5,7,10H2,1H3/t16-/m0/s1",COc1cc2c(cc1O)[C@@H]1Cc3cc(O)ccc3CN1CC2,C18H19NO3,,297.136493468,IWRZCJCFXSVREX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Aniba canelilla,6025330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Aniba'],['Aniba canelilla'],4,0,7.367802619934082 6467,2403,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.53451324,ISDB,AWUHBUKNSPYYTJ-JBPVSEGESA-N,"InChI=1S/C30H46O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9-10,19-20,22,25H,11-18H2,1-8H3/t19-,20+,22+,25+,27-,28+,29-,30-/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C)CC[C@]3(C)C(=CC=C4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C30H46O,,422.354866092,AWUHBUKNSPYYTJ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Marsdenia formosana,6067057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Marsdenieae'],['Marsdenia'],['Marsdenia formosana'],4,1,6.638052940368652 6468,2403,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.53451324,ISDB,AWUHBUKNSPYYTJ-JBPVSEGESA-N,"InChI=1S/C30H46O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9-10,19-20,22,25H,11-18H2,1-8H3/t19-,20+,22+,25+,27-,28+,29-,30-/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C)CC[C@]3(C)C(=CC=C4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C30H46O,,422.354866092,AWUHBUKNSPYYTJ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Saussurea ussuriensis,5739495.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea ussuriensis'],4,1,6.638052940368652 6469,2403,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.53451324,ISDB,AWUHBUKNSPYYTJ-JBPVSEGESA-N,"InChI=1S/C30H46O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9-10,19-20,22,25H,11-18H2,1-8H3/t19-,20+,22+,25+,27-,28+,29-,30-/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C)CC[C@]3(C)C(=CC=C4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C30H46O,,422.354866092,AWUHBUKNSPYYTJ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Diospyros malabarica,1049036.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ebenaceae'],['Unknown'],['Diospyros'],['Diospyros malabarica'],4,1,6.638052940368652 6470,2396,-1,,,,0.0,MS1_match,YUAYWSBSIJVIBS-UHFFFAOYSA-N,"InChI=1S/C10H14O2/c1-2-3-4-6-9(11)10-7-5-8-12-10/h5,7-8H,2-4,6H2,1H3",CCCCCC(=O)c1ccco1,C10H14O2,pos_2MNa,166.099379688,YUAYWSBSIJVIBS,,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6471,2395,-1,,,,0.21226151,ISDB,XHHOHZPNYFQJKL-QWRGUYRKSA-N,"InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)/t10-,11-/m0/s1",N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,C14H18N2O5,,294.121571676,XHHOHZPNYFQJKL,Amino acids and Peptides,Small peptides,Dipeptides,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,0,4.849046051502228 6472,2395,-1,,,,0.21226151,ISDB,XHHOHZPNYFQJKL-QWRGUYRKSA-N,"InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)/t10-,11-/m0/s1",N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,C14H18N2O5,,294.121571676,XHHOHZPNYFQJKL,Amino acids and Peptides,Small peptides,Dipeptides,Vigna radiata,806245.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Vigna'],['Vigna radiata'],4,0,4.849046051502228 6473,2395,-1,,,,0.21226151,ISDB,XHHOHZPNYFQJKL-QWRGUYRKSA-N,"InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)/t10-,11-/m0/s1",N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,C14H18N2O5,,294.121571676,XHHOHZPNYFQJKL,Amino acids and Peptides,Small peptides,Dipeptides,Vigna radiata var. radiata,1065946.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Vigna'],['Vigna radiata'],4,0,4.849046051502228 6474,2395,-1,,,,0.21226151,ISDB,XHHOHZPNYFQJKL-QWRGUYRKSA-N,"InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)/t10-,11-/m0/s1",N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,C14H18N2O5,,294.121571676,XHHOHZPNYFQJKL,Amino acids and Peptides,Small peptides,Dipeptides,Allium cepa,781600.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium cepa'],4,0,4.849046051502228 6475,2395,-1,,,,0.21226151,ISDB,XHHOHZPNYFQJKL-QWRGUYRKSA-N,"InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)/t10-,11-/m0/s1",N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,C14H18N2O5,,294.121571676,XHHOHZPNYFQJKL,Amino acids and Peptides,Small peptides,Dipeptides,Allium sativum,748370.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium sativum'],4,0,4.849046051502228 6476,2394,380,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,0.32516986,ISDB,ZNJCOKLSWJWJJU-NYNLCMDTSA-N,"InChI=1S/C14H16O3/c1-7-5-13-10(8(2)14(16)17-13)6-11-9(7)3-4-12(11)15/h7,10,13H,2-6H2,1H3/t7-,10+,13-/m0/s1",C=C1C(=O)O[C@H]2C[C@H](C)C3=C(C[C@H]12)C(=O)CC3,C14H16O3,,232.109944372,ZNJCOKLSWJWJJU,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,Mikania mendocina,7604044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Mikania'],['Mikania mendocina'],4,3,6.800679445266724 6477,2392,-1,,,,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_sodium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 6478,2392,-1,,,,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_sodium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 6479,2392,-1,,,,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_sodium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 6480,2389,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.38862,ISDB,VRPSNHRJPVYMJT-VGVXJFJMSA-N,"InChI=1S/C20H22O8/c1-26-16-10-13(5-6-14(16)22)20(25)18(11-21)28-15-7-3-12(4-8-19(23)24)9-17(15)27-2/h3-10,18,20-22,25H,11H2,1-2H3,(H,23,24)/b8-4+/t18-,20+/m0/s1",COc1cc([C@@H](O)[C@H](CO)Oc2ccc(/C=C/C(=O)O)cc2OC)ccc1O,C20H22O8,,390.131467664,VRPSNHRJPVYMJT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Aeschynanthus bracteatus,154188.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Gesneriaceae'],['Trichosporeae'],['Aeschynanthus'],['Aeschynanthus bracteatus'],4,0,5.554479956626892 6481,2389,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.38862,ISDB,VRPSNHRJPVYMJT-VGVXJFJMSA-N,"InChI=1S/C20H22O8/c1-26-16-10-13(5-6-14(16)22)20(25)18(11-21)28-15-7-3-12(4-8-19(23)24)9-17(15)27-2/h3-10,18,20-22,25H,11H2,1-2H3,(H,23,24)/b8-4+/t18-,20+/m0/s1",COc1cc([C@@H](O)[C@H](CO)Oc2ccc(/C=C/C(=O)O)cc2OC)ccc1O,C20H22O8,,390.131467664,VRPSNHRJPVYMJT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Solanum nigrum,494831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum nigrum'],4,0,5.554479956626892 6482,2385,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.20455688,ISDB,,,,,,,QWXQXTUTIXYVJD,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8182275295257568 6483,2381,864,Amino acids and Peptides,Cyclic polyketides,3-Spirotetramic acids,0.2649244,ISDB,KCVXNPDAHDGXFD-GMDXDWKASA-N,"InChI=1S/C14H17NO7/c15-5-9(7-2-1-3-8(17)4-7)21-14-13(20)12(19)11(18)10(6-16)22-14/h1-4,9-14,16-20H,6H2/t9-,10+,11+,12-,13+,14+/m0/s1",N#C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cccc(O)c1,C14H17NO7,,311.100501884,KCVXNPDAHDGXFD,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Sambucus nigra,1042130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Sambucus'],['Sambucus nigra'],5,1,6.55969762802124 6484,2380,1074,,,,0.28664836,ISDB,,,,,,,ZERCSHNDTDRBCI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.146593451499939 6485,2379,171,Terpenoids,Sesquiterpenoids,Wax monoesters,0.0,MS1_match,AAQRLPMQWQNFFZ-SYHUXOJYSA-N,"InChI=1S/C20H26O5/c1-15(2)14-19(21)24-13-11-16(3)20(22)25-12-5-6-17-7-9-18(23-4)10-8-17/h5-11,15H,12-14H2,1-4H3/b6-5+,16-11-",COc1ccc(/C=C/COC(=O)/C(C)=C\COC(=O)CC(C)C)cc1,C20H26O5,pos_1_sodium,346.178023932,AAQRLPMQWQNFFZ,Fatty acids,Fatty esters,Wax monoesters,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,3,7.5 6486,2378,-1,,,,0.0,MS1_match,RDFLLVCQYHQOBU-GPGGJFNDSA-O,"InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1/t17-,18-,19+,20+,21-,22+,23+,24+,26+,27+/m0/s1",OC[C@@H]1O[C@@H](Oc2cc(O)cc3[o+]c(-c4ccc(O)c(O)c4)c(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc23)[C@H](O)[C@@H](O)[C@@H]1O,C27H31O16+,pos_1_1proton,611.16066133209,RDFLLVCQYHQOBU,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 6487,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-UHFFFAOYSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(O)CC12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera tatarica var. morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 6488,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-VYDXWPHLSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9+,10-,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@H](O)C[C@H]12,C17H26O11,pos_1_sodium,406.1475116519999,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 6489,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-SFBCHFHNSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6490,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-UHFFFAOYSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(O)CC12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 6491,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-UHFFFAOYSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(O)CC12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera tatarica var. morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 6492,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_sodium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],7,0,7.0 6493,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-SFBCHFHNSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6494,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-UHFFFAOYSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(O)CC12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 6495,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-VYDXWPHLSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9+,10-,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@H](O)C[C@H]12,C17H26O11,pos_1_sodium,406.1475116519999,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 6496,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_sodium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],7,0,7.0 6497,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-VYDXWPHLSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9+,10-,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@H](O)C[C@H]12,C17H26O11,pos_1_sodium,406.1475116519999,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 6498,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-SFBCHFHNSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6499,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-UHFFFAOYSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(O)CC12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 6500,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-UHFFFAOYSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)OC(O)CC12,C17H26O11,pos_1_sodium,406.1475116519998,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera tatarica var. morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 6501,2376,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_sodium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],7,0,7.0 6502,2373,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LTVSLKWNAZKBEX-UHFFFAOYSA-N,"InChI=1S/C15H16O4/c1-10(2)5-15(17)19-8-12-7-18-9-14-11(6-16)3-4-13(12)14/h3-4,6-7,9-10H,5,8H2,1-2H3",CC(C)CC(=O)OCc1cocc2c(C=O)ccc1-2,C15H16O4,pos_1_1proton1ammonium,260.104858992,LTVSLKWNAZKBEX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6503,2373,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LTVSLKWNAZKBEX-UHFFFAOYSA-N,"InChI=1S/C15H16O4/c1-10(2)5-15(17)19-8-12-7-18-9-14-11(6-16)3-4-13(12)14/h3-4,6-7,9-10H,5,8H2,1-2H3",CC(C)CC(=O)OCc1cocc2c(C=O)ccc1-2,C15H16O4,pos_1_1proton1ammonium,260.104858992,LTVSLKWNAZKBEX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 6504,2373,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LTVSLKWNAZKBEX-UHFFFAOYSA-N,"InChI=1S/C15H16O4/c1-10(2)5-15(17)19-8-12-7-18-9-14-11(6-16)3-4-13(12)14/h3-4,6-7,9-10H,5,8H2,1-2H3",CC(C)CC(=O)OCc1cocc2c(C=O)ccc1-2,C15H16O4,pos_1_1proton1ammonium,260.104858992,LTVSLKWNAZKBEX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6505,2373,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LTVSLKWNAZKBEX-UHFFFAOYSA-N,"InChI=1S/C15H16O4/c1-10(2)5-15(17)19-8-12-7-18-9-14-11(6-16)3-4-13(12)14/h3-4,6-7,9-10H,5,8H2,1-2H3",CC(C)CC(=O)OCc1cocc2c(C=O)ccc1-2,C15H16O4,pos_1_1proton1ammonium,260.104858992,LTVSLKWNAZKBEX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 6506,2370,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.46242586,ISDB,OWJPGUSQKTZURC-ARHFQXALSA-N,"InChI=1S/C37H38O19/c1-50-24-9-16(4-6-19(24)41)23-12-22(44)29-21(43)10-17(11-25(29)52-23)51-36-35(33(49)31(47)26(13-38)53-36)56-37-34(32(48)30(46)27(14-39)54-37)55-28(45)7-3-15-2-5-18(40)20(42)8-15/h2-12,26-27,30-43,46-49H,13-14H2,1H3/b7-3+/t26-,27-,30-,31-,32+,33+,34-,35-,36-,37+/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4OC(=O)/C=C/c4ccc(O)c(O)c4)cc3o2)ccc1O,C37H38O19,,786.200728996,OWJPGUSQKTZURC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Sideritis ozturkii,6081668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis ozturkii'],4,3,7.349703431129456 6507,2369,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.0,MS1_match,HTKODPPFQUGBMU-GQJRUFTLSA-N,"InChI=1S/C19H30O8/c1-9(20)25-11-7-8-17(5,24)19-14(22)12(16(3,4)27-19)13(26-10(2)21)15(23)18(11,19)6/h11-15,22-24H,7-8H2,1-6H3/t11-,12+,13-,14+,15-,17-,18-,19-/m0/s1",CC(=O)O[C@H]1[C@@H]2[C@@H](O)[C@@]3(OC2(C)C)[C@@](C)([C@@H](OC(C)=O)CC[C@]3(C)O)[C@H]1O,C19H30O8,pos_1_1proton1ammonium,386.1940679199999,HTKODPPFQUGBMU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,1,6.5 6508,2369,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.0,MS1_match,HTKODPPFQUGBMU-GQJRUFTLSA-N,"InChI=1S/C19H30O8/c1-9(20)25-11-7-8-17(5,24)19-14(22)12(16(3,4)27-19)13(26-10(2)21)15(23)18(11,19)6/h11-15,22-24H,7-8H2,1-6H3/t11-,12+,13-,14+,15-,17-,18-,19-/m0/s1",CC(=O)O[C@H]1[C@@H]2[C@@H](O)[C@@]3(OC2(C)C)[C@@](C)([C@@H](OC(C)=O)CC[C@]3(C)O)[C@H]1O,C19H30O8,pos_1_1proton1ammonium,386.1940679199999,HTKODPPFQUGBMU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,1,6.5 6509,2367,-1,,,,0.0,MS1_match,NJTOSCMFMNLPNQ-UHFFFAOYSA-N,"InChI=1S/C14H10O4/c1-17-11-7-2-4-8-13(16)12-9(15)5-3-6-10(12)18-14(8)11/h2-7,15H,1H3",COc1cccc2c(=O)c3c(O)cccc3oc12,C14H10O4,pos_1_sodium,242.0579088,NJTOSCMFMNLPNQ,Shikimates and Phenylpropanoids,Xanthones,Plant xanthones,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 6510,2365,-1,,,,0.7983962,ISDB,,,,,,,DXVUYOAEDJXBPY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.19358491897583 6511,2359,-1,,,,0.3088534,ISDB,GUZAIURHRDPBKE-HIEJAJBWSA-N,"InChI=1S/C30H46O3/c1-17(2)18-9-12-22-29(18,7)25(33)16-28(6)19-10-11-21-26(3,4)23(31)13-14-27(21,5)20(19)15-24(32)30(22,28)8/h10,15,17-18,21-23,25,31,33H,9,11-14,16H2,1-8H3/t18-,21+,22-,23-,25-,27-,28-,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC(=O)[C@@]21C,C30H46O3,,454.344695332,GUZAIURHRDPBKE,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,8.235413551330566 6512,2357,578,Fatty acids,Monoterpenoids,Menthane monoterpenoids,0.21294595,ISDB,,,,,,,DRWNUSMKXPQONR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.851783812046051 6513,2354,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.92449397,ISDB,SBHXYTNGIZCORC-ZDUSSCGKSA-N,"InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2/t13-/m0/s1",O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c21,C15H12O6,,288.063388104,SBHXYTNGIZCORC,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,11.197975873947144 6514,2352,261,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2proton,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6515,2352,261,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,JZJSMQHXFBDMBB-RTQWZQBFSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(55-35)19-53-34-32(50)30(48)28(46)23(18-43)54-34)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(45)39(4,20-44)25(38)9-12-41(26,40)6/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2proton,796.4609068560001,JZJSMQHXFBDMBB,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6516,2352,261,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2proton,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,2,8.0 6517,2352,261,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,YEBCEGBBUMGPQI-OLTREEDVSA-N,"InChI=1S/C42H68O14/c1-37(2)13-15-42(36(52)56-35-33(51)31(49)29(47)24(19-44)54-35)16-14-40(5)21(22(42)17-37)7-8-26-38(3)11-10-27(39(4,20-45)25(38)9-12-41(26,40)6)55-34-32(50)30(48)28(46)23(18-43)53-34/h7,22-35,43-51H,8-20H2,1-6H3/t22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35-,38-,39-,40+,41+,42-/m0/s1",CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C42H68O14,pos_2_2proton,796.4609068560001,YEBCEGBBUMGPQI,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,2,8.0 6518,2352,261,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,ORESVIJUAVPRJL-XUJNLDPJSA-N,"InChI=1S/C42H68O14/c1-20(2)21-9-14-42(37(52)56-36-34(51)32(49)30(47)24(18-44)54-36)16-15-40(5)22(28(21)42)7-8-26-38(3)12-11-27(39(4,19-45)25(38)10-13-41(26,40)6)55-35-33(50)31(48)29(46)23(17-43)53-35/h21-36,43-51H,1,7-19H2,2-6H3/t21-,22+,23+,24+,25+,26+,27-,28+,29+,30+,31-,32-,33+,34+,35-,36-,38-,39-,40+,41+,42-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12,C42H68O14,pos_2_2proton,796.460906856,ORESVIJUAVPRJL,Terpenoids,Triterpenoids,Lupane triterpenoids,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,2,8.0 6519,2350,-1,,,,0.0,MS1_match,BKATZVAUANSCKN-QWRGUYRKSA-N,"InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1",CC(=O)OCC1=CC[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_1_1proton,194.130679816,BKATZVAUANSCKN,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6520,2350,-1,,,,0.0,MS1_match,PBWRFXQNNGSAQG-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3",C=C1C(OC(C)=O)CC2(C(C)C)CC12,C12H18O2,pos_1_1proton,194.130679816,PBWRFXQNNGSAQG,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6521,2350,-1,,,,0.0,MS1_match,ALVJDUNBMKMTDC-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-12(2,3)10-8-9(13-4)6-7-11(10)14-5/h6-8H,1-5H3",COc1ccc(OC)c(C(C)(C)C)c1,C12H18O2,pos_1_1proton,194.130679816,ALVJDUNBMKMTDC,Shikimates and Phenylpropanoids,,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6522,2350,-1,,,,0.0,MS1_match,RWENJYLCELUBAE-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-8(2)10-6-11(13-4)9(3)12(7-10)14-5/h6-8H,1-5H3",COc1cc(C(C)C)cc(OC)c1C,C12H18O2,pos_1_1proton,194.130679816,RWENJYLCELUBAE,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6523,2350,-1,,,,0.0,MS1_match,GVZSSHYAFJPRJY-GARJFASQSA-N,"InChI=1S/C12H18O2/c1-7-10-5-9(12(7,3)4)6-11(10)14-8(2)13/h9-11H,1,5-6H2,2-4H3/t9-,10-,11+/m0/s1",C=C1[C@@H]2C[C@@H](C[C@H]2OC(C)=O)C1(C)C,C12H18O2,pos_1_1proton,194.130679816,GVZSSHYAFJPRJY,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6524,2350,-1,,,,0.0,MS1_match,OZBFUQLOVFXDNK-VWYCJHECSA-N,"InChI=1S/C12H18O2/c1-7-5-11(14-8(2)13)10-6-9(7)12(10,3)4/h5,9-11H,6H2,1-4H3/t9-,10+,11+/m1/s1",CC(=O)O[C@H]1C=C(C)[C@H]2C[C@@H]1C2(C)C,C12H18O2,pos_1_1proton,194.130679816,OZBFUQLOVFXDNK,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6525,2347,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.55006844,ISDB,IMGCLEIFKMJSCC-UHFFFAOYSA-N,"InChI=1S/C26H32O13/c1-26(34)8-7-13-14(23(33)35-2)10-37-24(19(13)26)39-25-22(32)21(31)20(30)17(38-25)11-36-18(29)6-4-12-3-5-15(27)16(28)9-12/h3-6,9-10,13,17,19-22,24-25,27-28,30-32,34H,7-8,11H2,1-2H3",COC(=O)C1=COC(OC2OC(COC(=O)C=Cc3ccc(O)c(O)c3)C(O)C(O)C2O)C2C1CCC2(C)O,C26H32O13,,552.184291084,IMGCLEIFKMJSCC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Veronica officinalis,492806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Veroniceae'],['Veronica'],['Veronica officinalis'],4,2,7.200273752212524 6526,2346,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MHNH3,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6527,2346,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MHNH3,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 6528,2346,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MHNH3,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6529,2346,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MHNH3,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6530,2346,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MHNH3,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 6531,2346,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SFLMUHDGSQZDOW-FAOXUISGSA-N,"InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1",COc1cc(/C=C/CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O8,pos_2MHNH3,342.131467664,SFLMUHDGSQZDOW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6532,2345,408,,,,0.0,MS1_match,AALXOLVYFZPFPN-NSCUHMNNSA-N,"InChI=1S/C10H14O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-5,8,11-12H,6-7H2,1H3/b3-2+",COC1=C(O)C=CC(/C=C/CO)C1,C10H14O3,pos_2MHNH3,182.094294308,AALXOLVYFZPFPN,,,,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 6533,2345,408,,,,0.0,MS1_match,MWOMNLDJNQWJMK-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h4-5,7,11-12H,2-3,6H2,1H3",COc1cc(CCCO)ccc1O,C10H14O3,pos_2MHNH3,182.094294308,MWOMNLDJNQWJMK,,,,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 6534,2342,973,Terpenoids,Polyprenols,Labdane diterpenoids,0.37719944,ISDB,LVVVRYBRIUFULZ-XHARVQFDSA-N,"InChI=1S/C30H58O6/c1-23(13-9-19-27(3,4)33)15-11-21-29(7,35)25(31)17-18-26(32)30(8,36)22-12-16-24(2)14-10-20-28(5,6)34/h15-16,25-26,31-36H,9-14,17-22H2,1-8H3/b23-15+,24-16+/t25-,26-,29+,30+/m0/s1",C/C(=C\CC[C@@](C)(O)[C@@H](O)CC[C@H](O)[C@](C)(O)CC/C=C(\C)CCCC(C)(C)O)CCCC(C)(C)O,C30H58O6,,514.423339576,LVVVRYBRIUFULZ,Terpenoids,Polyprenols,Polyprenol derivatives,Irpex lacteus,60033.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Polyporales'],['Meruliaceae'],['Unknown'],['Irpex'],['Irpex lacteus'],1,2,3.508797764778137 6535,2341,-1,,,,0.0,MS1_match,JGXFMIJHKASCIZ-NODAHLOSSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23?/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6536,2341,-1,,,,0.0,MS1_match,JGXFMIJHKASCIZ-NODAHLOSSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23?/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6537,2340,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.31752244,ISDB,BFSRJRKZZSIEFP-MOHLSBLISA-N,"InChI=1S/C30H46O2/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-20-25(3,4)23(31)10-11-26(20,5)21(27)9-13-30(28,32-19-29)22(29)18-24/h9,13,20-22H,8,10-12,14-19H2,1-7H3/t20-,21-,22-,26+,27-,28+,29-,30-/m1/s1",CC1(C)CC[C@@]23CC[C@@]4(C)[C@]5(C)CC[C@@H]6C(C)(C)C(=O)CC[C@]6(C)[C@H]5C=C[C@@]4(OC2)[C@@H]3C1,C30H46O2,,438.349780712,BFSRJRKZZSIEFP,Terpenoids,Triterpenoids,Oleanane triterpenoids,Viburnum odoratissimum var. awabuki,90825.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum awabuki'],5,3,7.770089745521545 6538,2336,-1,,,,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_1_sodium,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 6539,2336,-1,,,,0.0,MS1_match,IBQVOWQTGYYRJP-GEHXJZNZSA-N,"InChI=1S/C26H32O13/c1-34-16-7-12(3-5-14(16)28)22-25(32)10-37-23(26(25,33)11-36-22)13-4-6-15(17(8-13)35-2)38-24-21(31)20(30)19(29)18(9-27)39-24/h3-8,18-24,27-33H,9-11H2,1-2H3/t18-,19-,20+,21-,22-,23-,24-,25+,26+/m1/s1",COc1cc([C@H]2OC[C@]3(O)[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O13,pos_1_sodium,552.1842910839998,IBQVOWQTGYYRJP,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6540,2332,690,Alkaloids,Cyclic polyketides,2-pyrone derivatives,0.54316247,ISDB,KOGLPFSKEKZVCZ-WCQYABFASA-N,"InChI=1S/C15H17NO5/c1-15(2)13(18)11(17)9-12(21-15)7-5-4-6-8(20-3)10(7)16-14(9)19/h4-6,11,13,17-18H,1-3H3,(H,16,19)/t11-,13+/m0/s1",COc1cccc2c3c(c(O)nc12)[C@H](O)[C@@H](O)C(C)(C)O3,C15H17NO5,,291.110672644,KOGLPFSKEKZVCZ,Alkaloids,,,Rauia resinosa,6126588.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Rauia'],['Rauia resinosa'],4,1,6.67264986038208 6541,2330,-1,,,,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 6542,2329,-1,,,,0.20524926,ISDB,NBCWSGSBMHILQP-GAGVYUBLSA-N,"InChI=1S/C17H26O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h6-7,12-15,17-22H,3-5,8H2,1-2H3/t12-,13-,14+,15-,17+/m1/s1",COc1cc(CCCO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H26O9,,374.1576824119999,NBCWSGSBMHILQP,,,,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.820997059345245 6543,2323,-1,,,,0.0,MS1_match,HRGUSFBJBOKSML-UHFFFAOYSA-N,"InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)17(14)21)12-7-11(20)16-10(19)5-9(18)6-13(16)24-12/h3-7,18-19,21H,1-2H3",COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc(OC)c1O,C17H14O7,pos_1_1proton,330.073952788,HRGUSFBJBOKSML,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 6544,2321,471,Shikimates and Phenylpropanoids,Monoterpenoids,Simple phenolic acids,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_2MHNH3,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 6545,2317,-1,,,,0.0,MS1_match,ZFOZVQLOBQUTQQ-UHFFFAOYSA-N,"InChI=1S/C18H32O7/c1-4-7-10-23-15(19)13-18(22,17(21)25-12-9-6-3)14-16(20)24-11-8-5-2/h22H,4-14H2,1-3H3",CCCCOC(=O)CC(O)(CC(=O)OCCCC)C(=O)OCCCC,C18H32O7,pos_1_1proton1ammonium,360.214803364,ZFOZVQLOBQUTQQ,Fatty acids,Fatty esters,Wax monoesters,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 6546,2316,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.34034312,ISDB,UPFPPGMSXLZFBF-YJLZBCFHSA-N,"InChI=1S/C27H46O12/c1-12-7-14(36-24-22(34)20(32)18(30)16(10-28)37-24)9-27(4)6-5-13(8-15(12)27)26(2,3)39-25-23(35)21(33)19(31)17(11-29)38-25/h13-25,28-35H,1,5-11H2,2-4H3/t13-,14+,15+,16-,17-,18-,19-,20+,21+,22-,23-,24-,25+,27+/m1/s1",C=C1C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@]2(C)CC[C@@H](C(C)(C)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]12,C27H46O12,,562.2989269119998,UPFPPGMSXLZFBF,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Atractylodes lancea,194037.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Atractylodes'],['Atractylodes lancea'],4,3,6.861372470855713 6547,2314,340,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.43102452,ISDB,GGBVEOSSAOGQGK-BRAKJYLBSA-N,"InChI=1S/C37H38O18/c1-48-20-12-22(41)27-24(13-20)52-31(18-5-7-19(39)8-6-18)32(29(27)44)54-35-33(30(45)28(43)25(14-38)53-35)55-36-34(46)37(47,16-51-36)15-50-26(42)10-4-17-3-9-21(40)23(11-17)49-2/h3-13,25,28,30,33-36,38-41,43,45-47H,14-16H2,1-2H3/b10-4+/t25-,28-,30+,33-,34+,35+,36+,37-/m1/s1",COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(COC(=O)/C=C/c4ccc(O)c(OC)c4)[C@H]3O)c(-c3ccc(O)cc3)oc2c1,C37H38O18,,770.205814376,GGBVEOSSAOGQGK,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Phyllolobium chinense,192321.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Astragalus'],['Astragalus complanatus'],4,3,7.224098086357117 6548,2313,-1,,,,0.0,MS1_match,RPMNUQRUHXIGHK-UHFFFAOYSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O14,pos_2MH,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 6549,2313,-1,,,,0.0,MS1_match,RPMNUQRUHXIGHK-PYXJVEIZSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_2MH,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6550,2312,566,Terpenoids,Monoterpenoids,Camphane monoterpenoids,0.28237966,ISDB,BVEVSYQMQABMQM-UHFFFAOYSA-N,"InChI=1S/C21H36O11/c1-19(2)9-4-12(20(19,3)5-10(9)23)32-17-15(26)14(25)13(24)11(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-18,22-28H,4-8H2,1-3H3",CC1(C)C2CC(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C1(C)CC2O,C21H36O11,,464.225761972,BVEVSYQMQABMQM,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.629518628120422 6551,2311,-1,,,,0.35806325,ISDB,KAXRCKJURNMODO-KKTIOXCDSA-N,"InChI=1S/C28H35ClO6/c1-13-14(2)24(31)34-22(13)23-15(3)27(32)10-9-17-16-11-20(29)18-7-6-8-21(30)25(18,4)19(16)12-28(33,35-23)26(17,27)5/h6-8,15-17,19-20,22-23,32-33H,9-12H2,1-5H3/t15-,16+,17+,19+,20+,22-,23+,25+,26+,27+,28-/m1/s1",CC1=C(C)[C@H]([C@H]2O[C@]3(O)C[C@H]4[C@@H](C[C@H](Cl)C5=CC=CC(=O)[C@@]54C)[C@@H]4CC[C@](O)([C@@H]2C)[C@]43C)OC1=O,C28H35ClO6,,502.21221652,KAXRCKJURNMODO,Terpenoids,Steroids,Ergostane steroids,Jaborosa magellanica,5784104.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Jaboroseae'],['Jaborosa'],['Jaborosa magellanica'],4,0,5.432253003120422 6552,2309,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.7152788,ISDB,GYFNYTZQAFYJEY-QTUDGBRCSA-N,"InChI=1S/C35H40O10/c1-13(12-36)7-24(37)44-35(42)21-10-20(21)32(4)22-9-17-16-8-19(16)33(5)26(17)27(25(28(38)29(33)39)15(3)30(40)43-6)34(22)18(11-23(32)35)14(2)31(41)45-34/h7,16,19-23,27,29,36,39,42H,8-12H2,1-6H3/b13-7+,25-15-/t16-,19-,20-,21+,22+,23-,27+,29+,32-,33+,34?,35-/m1/s1",COC(=O)/C(C)=C1\C(=O)[C@H](O)[C@]2(C)C3=C(C[C@@H]4C5(OC(=O)C(C)=C5C[C@H]5[C@](O)(OC(=O)/C=C(\C)CO)[C@H]6C[C@H]6[C@]45C)[C@H]31)[C@H]1C[C@H]12,C35H40O10,,620.26214748,GYFNYTZQAFYJEY,Terpenoids,Sesquiterpenoids,Cycloeudesmane sesquiterpenoids,Chloranthus fortunei,569911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Chloranthales'],['Chloranthaceae'],['Unknown'],['Chloranthus'],['Chloranthus fortunei'],4,2,7.861115217208862 6553,2307,637,Carbohydrates,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PIJWCPNNZULZBH-GRYWMYPUSA-N,"InChI=1S/C18H28O12/c1-7(20)12-8(4-11(21)26-2)9(16(25)27-3)6-28-17(12)30-18-15(24)14(23)13(22)10(5-19)29-18/h6-8,10,12-15,17-20,22-24H,4-5H2,1-3H3/t7-,8+,10+,12+,13+,14-,15+,17-,18-/m0/s1",COC(=O)C[C@@H]1C(C(=O)OC)=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1[C@H](C)O,C18H28O12,pos_1_1proton1acetonitrile,436.158076336,PIJWCPNNZULZBH,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],7,2,8.0 6554,2306,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.41777387,ISDB,,,,,,,DUWZSVUYUNQCKW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6710954904556274 6555,2303,-1,,,,0.41131374,ISDB,HSDKTWGTSNDEBZ-UHFFFAOYSA-N,"InChI=1S/C10H10O3/c1-2-3-7-4-9-10(5-8(7)11)13-6-12-9/h2,4-5,11H,1,3,6H2",C=CCc1cc2c(cc1O)OCO2,C10H10O3,,178.06299418,HSDKTWGTSNDEBZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Illicium anisatum,1059410.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Austrobaileyales'],['Schisandraceae'],['Unknown'],['Illicium'],['Illicium anisatum'],4,0,5.645254969596863 6556,2301,618,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,SODJPCZIKCWQDF-YDTXZKNUSA-N,"InChI=1S/C41H48N2O18/c1-18-19(2)35(50)59-32-29(49)33(60-36(51)24-12-13-26(48)43(9)15-24)40(17-54-20(3)44)34(58-23(6)47)30(56-21(4)45)27-31(57-22(5)46)41(40,39(32,8)53)61-38(27,7)16-55-37(52)25-11-10-14-42-28(18)25/h10-15,18-19,27,29-34,49,53H,16-17H2,1-9H3/t18-,19+,27-,29+,30-,31-,32+,33+,34-,38+,39+,40+,41+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@H](C)[C@H](C)C(=O)O[C@@H]([C@H](O)[C@@H]2OC(=O)c1ccc(=O)n(C)c1)[C@]4(C)O,C41H48N2O18,pos_2_2proton,856.290212696,SODJPCZIKCWQDF,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Semialarium mexicanum,857478.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Semialarium'],['Semialarium mexicanum'],6,3,7.5 6557,2301,618,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,SODJPCZIKCWQDF-UHFFFAOYSA-N,"InChI=1S/C41H48N2O18/c1-18-19(2)35(50)59-32-29(49)33(60-36(51)24-12-13-26(48)43(9)15-24)40(17-54-20(3)44)34(58-23(6)47)30(56-21(4)45)27-31(57-22(5)46)41(40,39(32,8)53)61-38(27,7)16-55-37(52)25-11-10-14-42-28(18)25/h10-15,18-19,27,29-34,49,53H,16-17H2,1-9H3",CC(=O)OCC12C(OC(=O)c3ccc(=O)n(C)c3)C(O)C3OC(=O)C(C)C(C)c4ncccc4C(=O)OCC4(C)OC1(C(OC(C)=O)C4C(OC(C)=O)C2OC(C)=O)C3(C)O,C41H48N2O18,pos_2_2proton,856.290212696,SODJPCZIKCWQDF,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Hippocratea volubilis,232493.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Hippocratea'],['Hippocratea volubilis'],6,3,7.5 6558,2301,618,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,OOZYNQOOJZTXAC-ANNCLGKJSA-N,"InChI=1S/C41H48N2O18/c1-18-19(2)35(50)60-33-30(59-36(51)24-12-13-26(48)43(9)15-24)34(58-23(6)47)40(17-54-20(3)44)31(49)29(56-21(4)45)27-32(57-22(5)46)41(40,39(33,8)53)61-38(27,7)16-55-37(52)25-11-10-14-42-28(18)25/h10-15,18-19,27,29-34,49,53H,16-17H2,1-9H3/t18-,19+,27-,29-,30+,31-,32-,33+,34+,38+,39+,40-,41+/m1/s1",CC(=O)OC[C@]12[C@H](O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(=O)c1ccc(=O)n(C)c1)[C@@H]2OC(C)=O)[C@]4(C)O,C41H48N2O18,pos_2_2proton,856.290212696,OOZYNQOOJZTXAC,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,3,7.5 6559,2301,618,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,GEQVEDBUJSREGY-VVNUXESFSA-N,"InChI=1S/C41H48N2O18/c1-18-19(2)35(50)60-33-30(59-36(51)24-12-13-26(48)43(9)15-24)31(49)40(17-54-20(3)44)34(58-23(6)47)29(56-21(4)45)27-32(57-22(5)46)41(40,39(33,8)53)61-38(27,7)16-55-37(52)25-11-10-14-42-28(18)25/h10-15,18-19,27,29-34,49,53H,16-17H2,1-9H3/t18-,19+,27-,29-,30-,31+,32-,33+,34-,38+,39+,40+,41+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(=O)c1ccc(=O)n(C)c1)[C@@H]2O)[C@]4(C)O,C41H48N2O18,pos_2_2proton,856.290212696,GEQVEDBUJSREGY,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,3,7.5 6560,2300,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2591133,ISDB,IZSBTQUUESEKPV-UHFFFAOYSA-N,"InChI=1S/C30H34O8/c1-17(2)23(33)11-8-18(3)6-5-7-19(4)12-13-29-22-10-9-20(31)15-25(22)38-30(29,36)28(35)27-24(34)14-21(32)16-26(27)37-29/h6,9-10,12,14-16,23,31-34,36H,1,5,7-8,11,13H2,2-4H3",C=C(C)C(O)CCC(C)=CCCC(C)=CCC12Oc3cc(O)cc(O)c3C(=O)C1(O)Oc1cc(O)ccc12,C30H34O8,,522.2253680479998,IZSBTQUUESEKPV,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Morus nigra,299656.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus nigra'],4,0,5.0364532470703125 6561,2299,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.20198399,ISDB,MMMDTKLGUHFRRJ-KPRDWXIZSA-N,"InChI=1S/C40H73NO9/c1-3-5-7-9-11-13-15-16-17-19-21-23-25-27-29-34(44)39(48)41-32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)33(43)28-26-24-22-20-18-14-12-10-8-6-4-2/h15-16,20-23,32-38,40,42-47H,3-14,17-19,24-31H2,1-2H3,(H,41,48)/b16-15+,22-20+,23-21+/t32-,33?,34?,35+,36+,37-,38+,40+/m0/s1",CCCCCCC/C=C/CC/C=C/CCCC(O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(O)CCC/C=C/CCCCCCCC,C40H73NO9,,711.528532916,MMMDTKLGUHFRRJ,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Penicillium,199764.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Unknown'],1,3,3.307935953140259 6562,2298,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 6563,2298,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6564,2298,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,2,8.0 6565,2298,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 6566,2298,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6567,2298,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,2,8.0 6568,2296,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.6189195,ISDB,YVJONNCAHSDDLZ-WEVVVXLNSA-N,"InChI=1S/C18H19NO4/c1-23-17-8-4-14(12-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+",COc1ccc(/C=C/C(=O)NCCc2ccc(O)cc2)cc1O,C18H19NO4,,313.131408088,YVJONNCAHSDDLZ,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Lycium chinense,58730.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Lycieae'],['Lycium'],['Lycium chinense'],4,3,7.975677967071533 6569,2295,-1,,,,0.0,MS1_match,XHCADAYNFIFUHF-UHFFFAOYSA-N,"InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2",O=c1ccc2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2o1,C15H16O9,pos_1_1proton1methanol,340.07943209199993,XHCADAYNFIFUHF,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 6570,2295,-1,,,,0.0,MS1_match,XHCADAYNFIFUHF-UHFFFAOYSA-N,"InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2",O=c1ccc2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2o1,C15H16O9,pos_1_1proton1methanol,340.07943209199993,XHCADAYNFIFUHF,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 6571,2295,-1,,,,0.0,MS1_match,XHCADAYNFIFUHF-UHFFFAOYSA-N,"InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2",O=c1ccc2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2o1,C15H16O9,pos_1_1proton1methanol,340.07943209199993,XHCADAYNFIFUHF,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 6572,2295,-1,,,,0.0,MS1_match,XHCADAYNFIFUHF-UHFFFAOYSA-N,"InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2",O=c1ccc2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2o1,C15H16O9,pos_1_1proton1methanol,340.07943209199993,XHCADAYNFIFUHF,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 6573,2295,-1,,,,0.0,MS1_match,XHCADAYNFIFUHF-UHFFFAOYSA-N,"InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2",O=c1ccc2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2o1,C15H16O9,pos_1_1proton1methanol,340.07943209199993,XHCADAYNFIFUHF,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 6574,2295,-1,,,,0.0,MS1_match,XHCADAYNFIFUHF-UHFFFAOYSA-N,"InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2",O=c1ccc2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2o1,C15H16O9,pos_1_1proton1methanol,340.07943209199993,XHCADAYNFIFUHF,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 6575,2294,-1,,,,0.7888901,ISDB,HBRFKORKLCCQOQ-IDOKYYSUSA-N,"InChI=1S/C18H28O3/c1-11-15(20)13(19)9-14-17(11,3)6-5-12-10-16(2,21)7-8-18(12,14)4/h12,14,20-21H,5-10H2,1-4H3/t12-,14-,16-,17+,18-/m0/s1",CC1=C(O)C(=O)C[C@@H]2[C@@]3(C)CC[C@](C)(O)C[C@@H]3CC[C@]12C,C18H28O3,,292.203844756,HBRFKORKLCCQOQ,Terpenoids,Diterpenoids,Erythroxylane diterpenoids,Ceriops tagal,163833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Rhizophoraceae'],['Unknown'],['Ceriops'],['Ceriops tagal'],4,0,7.155560493469238 6576,2293,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2582173,ISDB,HPEFWCAKFRCLBD-UHFFFAOYSA-N,"InChI=1S/C15H16O2/c1-17-15-10-13(9-14(16)11-15)8-7-12-5-3-2-4-6-12/h2-6,9-11,16H,7-8H2,1H3",COc1cc(O)cc(CCc2ccccc2)c1,C15H16O2,,228.115029752,HPEFWCAKFRCLBD,Shikimates and Phenylpropanoids,Stilbenoids,Monomeric stilbenes,Bauhinia purpurea,560318.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Bauhinia'],['Bauhinia purpurea'],4,0,5.032869219779968 6577,2293,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2582173,ISDB,HPEFWCAKFRCLBD-UHFFFAOYSA-N,"InChI=1S/C15H16O2/c1-17-15-10-13(9-14(16)11-15)8-7-12-5-3-2-4-6-12/h2-6,9-11,16H,7-8H2,1H3",COc1cc(O)cc(CCc2ccccc2)c1,C15H16O2,,228.115029752,HPEFWCAKFRCLBD,Shikimates and Phenylpropanoids,Stilbenoids,Monomeric stilbenes,Bletilla formosana,386665.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Arethuseae'],['Bletilla'],['Bletilla formosana'],4,0,5.032869219779968 6578,2293,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2582173,ISDB,HPEFWCAKFRCLBD-UHFFFAOYSA-N,"InChI=1S/C15H16O2/c1-17-15-10-13(9-14(16)11-15)8-7-12-5-3-2-4-6-12/h2-6,9-11,16H,7-8H2,1H3",COc1cc(O)cc(CCc2ccccc2)c1,C15H16O2,,228.115029752,HPEFWCAKFRCLBD,Shikimates and Phenylpropanoids,Stilbenoids,Monomeric stilbenes,Dendrobium nobile,508208.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Malaxideae'],['Dendrobium'],['Dendrobium nobile'],4,0,5.032869219779968 6579,2292,-1,,,,0.7127125,ISDB,NLJNYZLJCNVCNR-XJHXNNCMSA-N,"InChI=1S/C33H40O18/c1-10-19(36)22(39)25(42)31(45-10)48-15-8-16(35)18-17(9-15)49-29(13-4-6-14(34)7-5-13)30(21(18)38)51-33-27(44)24(41)28(12(3)47-33)50-32-26(43)23(40)20(37)11(2)46-32/h4-12,19-20,22-28,31-37,39-44H,1-3H3/t10-,11-,12-,19-,20-,22+,23+,24-,25+,26+,27+,28-,31-,32-,33-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H]4O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C33H40O18,,724.22146444,NLJNYZLJCNVCNR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cassinopsis madagascariensis,717828.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Icacinales'],['Icacinaceae'],['Unknown'],['Cassinopsis'],['Cassinopsis madagascariensis'],4,0,6.8508501052856445 6580,2290,566,Terpenoids,Monoterpenoids,Camphane monoterpenoids,0.4968856,ISDB,DSSYKIVIOFKYAU-XVKPBYJWSA-N,"InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10-/m0/s1",CC1(C)[C@H]2CC[C@@]1(C)C(=O)C2,C10H16O,,152.120115132,DSSYKIVIOFKYAU,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,9.487542390823364 6581,2287,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32358602,ISDB,SOAPJKOPHBEWOH-UHFFFAOYSA-N,"InChI=1S/C12H16/c1-9-3-5-11-6-4-10(2)8-12(11)7-9/h3,5,7,10H,4,6,8H2,1-2H3",Cc1ccc2c(c1)CC(C)CC2,C12H16,,160.125200512,SOAPJKOPHBEWOH,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,0,5.294344067573547 6582,2285,436,,,,0.4775953,ISDB,,,,,,,AXBVFQAJRRTLOV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.9103811979293823 6583,2284,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-BZDFKLGJSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16-,17+,18+,19+,20-,21-,22-/m0/s1",C=C1[C@H]2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_minus1proton2sodium,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium favargeri,209870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium favargeri'],6,0,6.0 6584,2284,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-BZDFKLGJSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16-,17+,18+,19+,20-,21-,22-/m0/s1",C=C1[C@H]2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_minus1proton2sodium,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,0,6.0 6585,2284,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-JPMOWHAPSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16?,17-,18-,19-,20+,21+,22+/m1/s1",C=C1C2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_minus1proton2sodium,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum jaluense,549539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum jaluense'],6,0,6.0 6586,2284,-1,,,,0.0,MS1_match,RXGJFLXLQIECAN-BZDFKLGJSA-N,"InChI=1S/C22H34NO2/c1-15-16-4-8-21(19(15)25)9-5-17-20(2)6-3-7-22(17,18(21)12-16)14-23(13-20)10-11-24/h14,16-19,24-25H,1,3-13H2,2H3/q+1/t16-,17+,18+,19+,20-,21-,22-/m0/s1",C=C1[C@H]2CC[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(C=[N+](CCO)C5)[C@@H]3C2)[C@@H]1O,C22H34NO2+,pos_1_minus1proton2sodium,344.25840574809,RXGJFLXLQIECAN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orochryseum,6131466.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orochryseum'],6,0,6.0 6587,2282,637,Carbohydrates,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ATFJUGCMEQBNLH-UHFFFAOYSA-N,"InChI=1S/C10H14O5/c1-10-6(12)2-4-5(3-11)9(15-10)14-8(13)7(4)10/h4-7,9,11-12H,2-3H2,1H3",CC12OC3OC(=O)C1C(CC2O)C3CO,C10H14O5,pos_2MHNH3,214.084123548,ATFJUGCMEQBNLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6588,2281,109,Terpenoids,Diterpenoids,Estrane steroids,0.63191175,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.027647018432617 6589,2272,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,YDYHOAALGZGNKR-IVTISIJFSA-N,"InChI=1S/C28H40O10/c1-8-18(6)11-25(32)37-22-12-21-20(13-34-19(7)29)14-35-27(38-24(31)10-17(4)5)26(21)28(22,33)15-36-23(30)9-16(2)3/h10,12,14,16,18,22,26-27,33H,8-9,11,13,15H2,1-7H3/t18-,22-,26+,27-,28+/m0/s1",CC[C@H](C)CC(=O)O[C@H]1C=C2C(COC(C)=O)=CO[C@@H](OC(=O)C=C(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)C,C28H40O10,pos_2_2proton2acetonitrile,536.26214748,YDYHOAALGZGNKR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,3,7.5 6590,2270,-1,,,,0.31972829,ISDB,PKDTXFWHZWYNAH-ZABHBOMESA-N,"InChI=1S/C19H34O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h7,11-17,20-25H,5-6,8-9H2,1-4H3/t11-,12-,13-,14-,15+,16-,17+,19-/m1/s1",CC1=C[C@@H](O)CC(C)(C)[C@@]1(O)CC[C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H34O8,,390.225368048,PKDTXFWHZWYNAH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Cydonia oblonga,941743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Cydonia'],['Cydonia oblonga'],4,0,5.278913140296936 6591,2270,-1,,,,0.31972829,ISDB,PKDTXFWHZWYNAH-ZABHBOMESA-N,"InChI=1S/C19H34O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h7,11-17,20-25H,5-6,8-9H2,1-4H3/t11-,12-,13-,14-,15+,16-,17+,19-/m1/s1",CC1=C[C@@H](O)CC(C)(C)[C@@]1(O)CC[C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H34O8,,390.225368048,PKDTXFWHZWYNAH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Cydonia vulgaris,316549.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Chaenomeles'],['Chaenomeles sinensis'],4,0,5.278913140296936 6592,2269,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_1potassium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 6593,2269,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_1potassium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 6594,2269,-1,,,,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_1potassium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,0,8.0 6595,2268,-1,,,,0.0,MS1_match,NDHTVWHEZTVRJI-HVLDEAOBSA-N,"InChI=1S/C27H40O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h11,13,15-17,21,25-26,32H,8-10,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H40O10,pos_2_1proton1sodium,524.26214748,NDHTVWHEZTVRJI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6596,2268,-1,,,,0.0,MS1_match,NDHTVWHEZTVRJI-HVLDEAOBSA-N,"InChI=1S/C27H40O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h11,13,15-17,21,25-26,32H,8-10,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H40O10,pos_2_1proton1sodium,524.26214748,NDHTVWHEZTVRJI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 6597,2268,-1,,,,0.0,MS1_match,NDHTVWHEZTVRJI-HVLDEAOBSA-N,"InChI=1S/C27H40O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h11,13,15-17,21,25-26,32H,8-10,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H40O10,pos_2_1proton1sodium,524.26214748,NDHTVWHEZTVRJI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana alliariifolia,5746411.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana alliariifolia'],6,0,6.0 6598,2268,-1,,,,0.0,MS1_match,YPWCGDRLINNRAD-HVLDEAOBSA-N,"InChI=1S/C27H40O10/c1-15(2)8-22(29)33-12-19-13-34-26(37-24(31)10-17(5)6)25-20(19)11-21(36-18(7)28)27(25,32)14-35-23(30)9-16(3)4/h11,13,15-17,21,25-26,32H,8-10,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)C,C27H40O10,pos_2_1proton1sodium,524.26214748,YPWCGDRLINNRAD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 6599,2267,-1,,,,0.0,MS1_match,QJVXKWHHAMZTBY-CZZVJJMOSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3-/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C\CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_sodium,372.1420323479999,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 6600,2267,-1,,,,0.0,MS1_match,QJVXKWHHAMZTBY-CZZVJJMOSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3-/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C\CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_sodium,372.1420323479999,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 6601,2263,-1,,,,0.400271,ISDB,BFCXCFJUDBNEMU-QPIZCGMOSA-N,"InChI=1S/C33H40O20/c1-9-19(37)23(41)26(44)31(48-9)47-8-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-15(36)6-12(50-32-27(45)24(42)20(38)10(2)49-32)7-16(18)51-29(30)11-3-4-13(34)14(35)5-11/h3-7,9-10,17,19-21,23-28,31-39,41-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O20,,756.2112936800003,BFCXCFJUDBNEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,0,7.601083993911743 6602,2262,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,PBLWZMSRSJTRHJ-NCIRKIHRSA-N,"InChI=1S/C32H44O16/c1-42-20-8-14(3-5-18(20)45-31-28(40)26(38)24(36)22(11-34)47-31)7-16-13-44-30(17(16)10-33)15-4-6-19(21(9-15)43-2)46-32-29(41)27(39)25(37)23(12-35)48-32/h3-6,8-9,16-17,22-41H,7,10-13H2,1-2H3/t16-,17-,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H44O16,pos_2_2proton2acetonitrile,684.262935328,PBLWZMSRSJTRHJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,1,8.5 6603,2260,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.20571831,ISDB,FLLLEVXQNGRTCK-RMOHBAFUSA-N,"InChI=1S/C26H32O14/c1-35-17-8-13(9-27)2-7-16(17)39-24-21(31)20(30)19(29)18(40-24)10-36-25-22(32)26(34,12-38-25)11-37-23(33)14-3-5-15(28)6-4-14/h2-8,18-22,24-25,27-32,34H,9-12H2,1H3/t18-,19-,20+,21-,22+,24-,25-,26-/m1/s1",COc1cc(CO)ccc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(COC(=O)c3ccc(O)cc3)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C26H32O14,,568.179205704,FLLLEVXQNGRTCK,Shikimates and Phenylpropanoids,,,Handroanthus impetiginosus,532896.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Unknown'],['Handroanthus'],['Handroanthus impetiginosus'],4,0,4.82287323474884 6604,2260,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.20571831,ISDB,FLLLEVXQNGRTCK-RMOHBAFUSA-N,"InChI=1S/C26H32O14/c1-35-17-8-13(9-27)2-7-16(17)39-24-21(31)20(30)19(29)18(40-24)10-36-25-22(32)26(34,12-38-25)11-37-23(33)14-3-5-15(28)6-4-14/h2-8,18-22,24-25,27-32,34H,9-12H2,1H3/t18-,19-,20+,21-,22+,24-,25-,26-/m1/s1",COc1cc(CO)ccc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(COC(=O)c3ccc(O)cc3)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C26H32O14,,568.179205704,FLLLEVXQNGRTCK,Shikimates and Phenylpropanoids,,,Handroanthus impetiginosum,532896.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Bignoniaceae'],['Unknown'],['Handroanthus'],['Handroanthus impetiginosus'],4,0,4.82287323474884 6605,2256,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5088372,ISDB,TZAXQHDIMDQXRD-YJQAKTFBSA-N,"InChI=1S/C19H22O5/c1-4-9-18-10-5-6-16(21)19(18,22)24-17(12(18)2)13-7-8-14(20)15(11-13)23-3/h4-8,11-12,17,20,22H,1,9-10H2,2-3H3/t12-,17+,18-,19-/m1/s1",C=CC[C@]12CC=CC(=O)[C@@]1(O)O[C@H](c1ccc(O)c(OC)c1)[C@H]2C,C19H22O5,,330.146723804,TZAXQHDIMDQXRD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Aniba ferrea,6025335.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Aniba'],['Aniba ferrea'],4,3,7.535348892211914 6606,2252,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.73632973,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,10.445318937301636 6607,2252,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.73632973,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,3,10.445318937301636 6608,2252,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.73632973,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,10.445318937301636 6609,2251,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.50592273,ISDB,GZYSVGWNLDGWPZ-WOPDTQHZSA-N,"InChI=1S/C13H23NO2/c1-3-10(2)13(15)16-9-11-6-8-14-7-4-5-12(11)14/h10-12H,3-9H2,1-2H3/t10-,11+,12+/m1/s1",CC[C@@H](C)C(=O)OC[C@@H]1CCN2CCC[C@@H]12,C13H23NO2,,225.172878976,GZYSVGWNLDGWPZ,Alkaloids,Ornithine alkaloids,Pyrrolizidine alkaloids,Osyris alba,124275.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Santalales'],['Santalaceae'],['Unknown'],['Osyris'],['Osyris alba'],4,2,7.023690938949585 6610,2245,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.9354539,ISDB,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,11.241815567016602 6611,2245,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.9354539,ISDB,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,11.241815567016602 6612,2245,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.9354539,ISDB,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,11.241815567016602 6613,2239,-1,,,,0.0,MS1_match,RPMNUQRUHXIGHK-UHFFFAOYSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O14,pos_1_sodium,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 6614,2239,-1,,,,0.0,MS1_match,RPMNUQRUHXIGHK-PYXJVEIZSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_sodium,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6615,2237,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.6216283,ISDB,WTPJVIGCNHPGKJ-KJTGTQQJSA-N,"InChI=1S/C18H19NO5/c1-24-17(22)12-18(23)10-9-14(20)11-15(18)19-16(21)8-7-13-5-3-2-4-6-13/h2-10,15,23H,11-12H2,1H3,(H,19,21)/b8-7+/t15-,18-/m0/s1",COC(=O)C[C@@]1(O)C=CC(=O)C[C@@H]1NC(=O)/C=C/c1ccccc1,C18H19NO5,,329.126322708,WTPJVIGCNHPGKJ,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Toussaintia orientalis,704447.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Toussaintia'],['Toussaintia orientalis'],4,3,7.986513137817383 6616,2234,-1,,,,0.509751,ISDB,VHVLBZCVJBGAGR-UHFFFAOYSA-N,"InChI=1S/C9H12O/c10-9-6-2-4-7-3-1-5-8(7)9/h5,7H,1-4,6H2",O=C1CCCC2CCC=C12,C9H12O,,136.088815004,VHVLBZCVJBGAGR,,,,Nepeta nepetella,482710.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Nepeta'],['Nepeta nepetella'],4,0,6.03900408744812 6617,2233,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.38075995,ISDB,MAIRBOUIUZTTQK-UHFFFAOYSA-N,"InChI=1S/C39H62O5/c1-4-6-8-10-12-14-16-18-20-22-24-26-31-28-32(40)29-34(41)37(31)38-33(39(43)36(44-3)30-35(38)42)27-25-23-21-19-17-15-13-11-9-7-5-2/h28-30,40-41H,4-27H2,1-3H3",CCCCCCCCCCCCCC1=C(c2c(O)cc(O)cc2CCCCCCCCCCCCC)C(=O)C=C(OC)C1=O,C39H62O5,,610.459725084,MAIRBOUIUZTTQK,Polyketides,Aromatic polyketides,Catechols with side chains,Ardisia brevicaulis,223967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia brevicaulis'],4,1,6.023039817810059 6618,2231,-1,,,,0.38054895,ISDB,NSOPGAYUGBZWHL-UHFFFAOYSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC=CCC=CCC=CCC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Angelica sinensis,182228.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Angelica'],['Angelica sinensis'],4,0,5.522195816040039 6619,2231,-1,,,,0.38054895,ISDB,NSOPGAYUGBZWHL-UHFFFAOYSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC=CCC=CCC=CCC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,0,5.522195816040039 6620,2231,-1,,,,0.38054895,ISDB,NSOPGAYUGBZWHL-YTWBPVBXSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,5.522195816040039 6621,2228,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.32331875,ISDB,BHIIRUKUMCZDIB-UHFFFAOYSA-N,"InChI=1S/C10H12O3/c1-3-4-7-5-8(11)10(12)9(6-7)13-2/h3,5-6,11-12H,1,4H2,2H3",C=CCc1cc(O)c(O)c(OC)c1,C10H12O3,,180.078644244,BHIIRUKUMCZDIB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Bulbine capitata,3996613.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asphodelaceae'],['Unknown'],['Bulbine'],['Bulbine capitata'],4,3,6.793274998664856 6622,2227,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.87928855,ISDB,MDAXYSXRAMOWLY-UHFFFAOYSA-N,"InChI=1S/C12H16/c1-9-7-10(2)12-6-4-3-5-11(12)8-9/h7-8H,3-6H2,1-2H3",Cc1cc(C)c2c(c1)CCCC2,C12H16,,160.125200512,MDAXYSXRAMOWLY,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,3,9.017154216766357 6623,2226,1436,Terpenoids,Octadecanoids,Other Octadecanoids,0.7483109,ISDB,ACHDMUPTZYZIGR-JPAZTHTMSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3+,8-6+,14-11+",CC/C=C/C/C=C/C=C/C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,8.49324369430542 6624,2226,1436,Terpenoids,Octadecanoids,Other Octadecanoids,0.7483109,ISDB,ACHDMUPTZYZIGR-CUHSZNQNSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3-,8-6-,14-11+",CC/C=C\C/C=C\C=C\C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Isatis tinctoria,631500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Isatideae'],['Isatis'],['Isatis tinctoria'],4,3,8.49324369430542 6625,2225,-1,,,,0.0,MS1_match,JVAVVXRDSNKYPD-UHFFFAOYSA-N,"InChI=1S/C15H20O4/c1-9-4-3-5-11(15(17)18)7-12-8-13(12)14(6-9)19-10(2)16/h4,7,12-14H,3,5-6,8H2,1-2H3,(H,17,18)",CC(=O)OC1CC(C)=CCCC(C(=O)O)=CC2CC21,C15H20O4,pos_1_1proton,264.13615912,JVAVVXRDSNKYPD,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6626,2225,-1,,,,0.0,MS1_match,JVAVVXRDSNKYPD-UHFFFAOYSA-N,"InChI=1S/C15H20O4/c1-9-4-3-5-11(15(17)18)7-12-8-13(12)14(6-9)19-10(2)16/h4,7,12-14H,3,5-6,8H2,1-2H3,(H,17,18)",CC(=O)OC1CC(C)=CCCC(C(=O)O)=CC2CC21,C15H20O4,pos_1_1proton,264.13615912,JVAVVXRDSNKYPD,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 6627,2225,-1,,,,0.0,MS1_match,GYTISTMGTHKMCE-RMHXPDDSSA-N,"InChI=1S/C15H20O4/c1-7-5-8(16)6-9-10(17)11-12(19-11)13(14(2,3)18)15(7,9)4/h6-7,11-13,18H,5H2,1-4H3/t7-,11-,12-,13+,15+/m1/s1",C[C@@H]1CC(=O)C=C2C(=O)[C@H]3O[C@H]3[C@@H](C(C)(C)O)[C@]21C,C15H20O4,pos_1_1proton,264.13615912,GYTISTMGTHKMCE,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 6628,2223,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XNOOTNIUGJXYKK-RSCBJFFSSA-N,"InChI=1S/C21H28O8/c1-3-4-9-29-20(26)21(27)11-14(19(25)17(24)12-21)15(22)7-5-13-6-8-16(23)18(10-13)28-2/h5-8,10,14,17,19,23-25,27H,3-4,9,11-12H2,1-2H3/b7-5+/t14-,17+,19-,21+/m0/s1",CCCCOC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](C(=O)/C=C/c2ccc(O)c(OC)c2)C1,C21H28O8,pos_1_1proton,408.178417856,XNOOTNIUGJXYKK,,,,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 6629,2223,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,FXSIWHQTOJDCOQ-JDFJRVMQSA-N,"InChI=1S/C21H28O8/c1-3-4-9-29-20(26)21(27)11-16(24)19(17(25)12-21)15(23)8-6-13-5-7-14(22)18(10-13)28-2/h5-8,10,16-17,19,22,24-25,27H,3-4,9,11-12H2,1-2H3/b8-6+/t16-,17-,19?,21?/m1/s1",CCCCOC(=O)C1(O)C[C@@H](O)C(C(=O)/C=C/c2ccc(O)c(OC)c2)[C@H](O)C1,C21H28O8,pos_1_1proton,408.178417856,FXSIWHQTOJDCOQ,,,,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 6630,2222,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.30942526,ISDB,IYGJNXKQEYRFJG-UHFFFAOYSA-N,"InChI=1S/C21H24O8/c1-26-18-10-13(4-7-15(18)22)5-9-20(25)29-12-17(24)21(28-3)14-6-8-16(23)19(11-14)27-2/h4-11,17,21-24H,12H2,1-3H3",COc1cc(C=CC(=O)OCC(O)C(OC)c2ccc(O)c(OC)c2)ccc1O,C21H24O8,,404.147117728,IYGJNXKQEYRFJG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Angelica sinensis,182228.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Angelica'],['Angelica sinensis'],4,0,5.237701058387756 6631,2221,-1,,,,0.48363146,ISDB,DRVBFTZBBRULEX-LHWCIIDMSA-N,"InChI=1S/C30H48O2/c1-18(2)19-9-12-23-28(6)16-13-20-21(29(28,7)17-25(32)30(19,23)8)10-11-22-26(3,4)24(31)14-15-27(20,22)5/h10,13,18-19,22-25,31-32H,9,11-12,14-17H2,1-8H3/t19-,22+,23+,24-,25-,27-,28+,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC[C@@]21C,C30H48O2,,440.365430776,DRVBFTZBBRULEX,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,8.934525847434998 6632,2220,109,Terpenoids,Diterpenoids,Estrane steroids,0.6031287,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.912514686584473 6633,2219,551,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Furans,0.0,MS1_match,NOEGNKMFWQHSLB-UHFFFAOYSA-N,"InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2",O=Cc1ccc(CO)o1,C6H6O3,pos_1_1proton,126.031694052,NOEGNKMFWQHSLB,Polyketides,Cyclic polyketides,Furans,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 6634,2217,973,Terpenoids,Polyprenols,Labdane diterpenoids,0.44477376,ISDB,,,,,,,MTBHPRPACUWIHF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.7790950536727905 6635,2214,170,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1acetonitrile,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 6636,2212,357,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,0.40191886,ISDB,YUCVPZILWXKQCX-HGSXXTALSA-N,"InChI=1S/C27H30N2O10/c1-2-11-13-7-17-20-14(12-5-3-4-6-16(12)28-20)8-18(25(35)36)29(17)24(34)15(13)10-37-26(11)39-27-23(33)22(32)21(31)19(9-30)38-27/h2-6,10-11,13,17-19,21-23,26-28,30-33H,1,7-9H2,(H,35,36)/t11-,13+,17+,18+,19+,21+,22-,23+,26+,27-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C2C(=O)N3[C@H](C(=O)O)Cc4c([nH]c5ccccc45)[C@@H]3C[C@H]21,C27H30N2O10,,542.19004516,YUCVPZILWXKQCX,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Nauclea diderrichii,916015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Nauclea'],['Nauclea diderrichii'],4,3,7.1076754331588745 6637,2208,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.5692549,ISDB,VZZQQZMZDJETCS-GUKRZAEASA-N,"InChI=1S/C20H20O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-4,6-9,11-13,21-22,24H,5,10H2,1H3/b9-4+,17-13-",COc1cc(CCC(=O)/C=C(O)/C=C/c2ccc(O)cc2)ccc1O,C20H20O5,,340.13107374,VZZQQZMZDJETCS,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Aframomum letestuanum,791472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Aframomum'],['Aframomum letestuanum'],4,3,7.777019500732422 6638,2207,1074,,,,0.35044634,ISDB,,,,,,,UUHLSBBVRGOGFW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4017853736877441 6639,2204,41,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,LTRLDPJSMLPKMF-YKXWAFRCSA-N,"InChI=1S/C25H40O10/c1-12-9-14(26)10-25(3,4)15(12)6-5-13(2)34-24-23(32)22(31)21(30)18(35-24)11-33-17-8-7-16(27)19(28)20(17)29/h5-6,9,13,15-24,27-32H,7-8,10-11H2,1-4H3/b6-5+/t13-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2CC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C25H40O10,pos_1_1proton1methanol,500.26214748,LTRLDPJSMLPKMF,Terpenoids,Apocarotenoids,Megastigmanes,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 6640,2203,-1,,,,0.0,MS1_match,CVNWHGNSIXIBPG-GWKMRXIPSA-N,"InChI=1S/C20H24O5/c1-5-17(14-25-19(21)13-15(2)3)20(22)24-12-6-7-16-8-10-18(23-4)11-9-16/h5-11,13H,12,14H2,1-4H3/b7-6+,17-5-",C/C=C(/COC(=O)C=C(C)C)C(=O)OC/C=C/c1ccc(OC)cc1,C20H24O5,pos_1_sodium,344.162373868,CVNWHGNSIXIBPG,,,,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 6641,2203,-1,,,,0.0,MS1_match,OOFFFDNFBGROFL-WYWILGHBSA-N,"InChI=1S/C20H24O5/c1-5-15(2)19(21)25-14-12-16(3)20(22)24-13-6-7-17-8-10-18(23-4)11-9-17/h5-12H,13-14H2,1-4H3/b7-6+,15-5-,16-12-",C/C=C(/C)C(=O)OC/C=C(/C)C(=O)OC/C=C/c1ccc(OC)cc1,C20H24O5,pos_1_sodium,344.162373868,OOFFFDNFBGROFL,,,,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 6642,2203,-1,,,,0.0,MS1_match,KRXLVSZOLMEYHF-SUOLFYLESA-N,"InChI=1S/C20H24O5/c1-5-15(3)19(21)25-14-17(6-2)20(22)24-13-7-8-16-9-11-18(23-4)12-10-16/h5-12H,13-14H2,1-4H3/b8-7+,15-5-,17-6-",C/C=C(/C)C(=O)OC/C(=C/C)C(=O)OC/C=C/c1ccc(OC)cc1,C20H24O5,pos_1_sodium,344.162373868,KRXLVSZOLMEYHF,,,,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 6643,2203,-1,,,,0.0,MS1_match,KRXLVSZOLMEYHF-UHFFFAOYSA-N,"InChI=1S/C20H24O5/c1-5-15(3)19(21)25-14-17(6-2)20(22)24-13-7-8-16-9-11-18(23-4)12-10-16/h5-12H,13-14H2,1-4H3",CC=C(C)C(=O)OCC(=CC)C(=O)OCC=Cc1ccc(OC)cc1,C20H24O5,pos_1_sodium,344.162373868,KRXLVSZOLMEYHF,,,,Cryptothladia chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,0,6.0 6644,2202,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,JUJTUEBXXGRSJB-MTAKFWDWSA-N,"InChI=1S/C17H26O9/c1-3-9-10-4-12(22-2)23-6-8(10)7-24-16(9)26-17-15(21)14(20)13(19)11(5-18)25-17/h3,7,9-21H,1,4-6H2,2H3/t9-,10-,11-,12-,13-,14+,15-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2CO[C@@H](OC)C[C@H]21,C17H26O9,pos_1_1proton,374.1576824119999,JUJTUEBXXGRSJB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6645,2201,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QTZXVESWHBGRDB-MGHIWKHDSA-N,"InChI=1S/C32H42O18/c1-12-17(8-14-15(29(42)43)11-45-30(22(12)14)50-32-28(41)26(39)24(37)20(10-34)49-32)46-21(35)6-4-13-3-5-16(18(7-13)44-2)47-31-27(40)25(38)23(36)19(9-33)48-31/h3-7,11-12,14,17,19-20,22-28,30-34,36-41H,8-10H2,1-2H3,(H,42,43)/b6-4+/t12-,14-,17+,19+,20+,22+,23+,24+,25-,26-,27+,28+,30-,31-,32-/m0/s1",COc1cc(/C=C/C(=O)O[C@@H]2C[C@H]3C(C(=O)O)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)ccc1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H42O18,pos_1_1proton1ammonium,714.237114504,QTZXVESWHBGRDB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 6646,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-HNNXBMFYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1",COc1cc2c(cc1O)CN(C)C[C@H]2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Galanthus elwesii,1090686.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Galanthus'],['Galanthus elwesii'],4,2,8.04990005493164 6647,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-HNNXBMFYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1",COc1cc2c(cc1O)CN(C)C[C@H]2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Leucojum aestivum,779382.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Leucojum'],['Leucojum aestivum'],4,2,8.04990005493164 6648,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Causonis trifolia,438626.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Cayratieae'],['Causonis'],['Causonis trifolia'],4,2,8.04990005493164 6649,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-HNNXBMFYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1",COc1cc2c(cc1O)CN(C)C[C@H]2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Narcissus angustifolius,3994344.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Narcissus'],['Narcissus tenuior'],4,2,8.04990005493164 6650,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-HNNXBMFYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1",COc1cc2c(cc1O)CN(C)C[C@H]2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Crinum lugardiae,439683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Crinum'],['Crinum lugardiae'],4,2,8.04990005493164 6651,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-HNNXBMFYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1",COc1cc2c(cc1O)CN(C)C[C@H]2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Brunsvigia radulosa,827218.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Brunsvigia'],['Brunsvigia radulosa'],4,2,8.04990005493164 6652,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Tetrastigma angustifolia,6045299.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Cayratieae'],['Tetrastigma'],['Tetrastigma angustifolia'],4,2,8.04990005493164 6653,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Nerine bowdenii,695840.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Nerine'],['Nerine bowdenii'],4,2,8.04990005493164 6654,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Lycoris guangxiensis,3994688.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Lycoris'],['Lycoris guangxiensis'],4,2,8.04990005493164 6655,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Crinum latifolium,118200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Crinum'],['Crinum latifolium'],4,2,8.04990005493164 6656,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Crinum bulbispermum,639815.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Crinum'],['Crinum bulbispermum'],4,2,8.04990005493164 6657,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Crinum moorei,564146.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Crinum'],['Crinum moorei'],4,2,8.04990005493164 6658,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-HNNXBMFYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1",COc1cc2c(cc1O)CN(C)C[C@H]2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Calostemma purpureum,968852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Calostemma'],['Calostemma purpureum'],4,2,8.04990005493164 6659,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-UHFFFAOYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3",COc1cc2c(cc1O)CN(C)CC2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Crinum asiaticum,34645.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Crinum'],['Crinum asiaticum'],4,2,8.04990005493164 6660,2199,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.762475,ISDB,VXXVFIKKBBVGIR-HNNXBMFYSA-N,"InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1",COc1cc2c(cc1O)CN(C)C[C@H]2c1ccc(O)cc1,C17H19NO3,,285.136493468,VXXVFIKKBBVGIR,Alkaloids,Tyrosine alkaloids,Tetrahydroisoquinoline alkaloids,Crinum macowanii,826238.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Crinum'],['Crinum macowanii'],4,2,8.04990005493164 6661,2198,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XWOHZIIPBYAMJX-KHBMLBSESA-N,"InChI=1S/C11H16O5/c1-5-8(12)3-6-7(10(13)15-2)4-16-11(14)9(5)6/h4-6,8-9,11-12,14H,3H2,1-2H3/t5-,6+,8-,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C11H16O5,pos_1_1proton1ammonium,228.099773612,XWOHZIIPBYAMJX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,3,7.5 6662,2198,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HJTVDWWIPXDJBB-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-6(5-12)7-4-8(13)11(2,15)9(7)10(14)16-3/h5,7-9,13,15H,1,4H2,2-3H3",C=C(C=O)C1CC(O)C(C)(O)C1C(=O)OC,C11H16O5,pos_1_1proton1ammonium,228.099773612,HJTVDWWIPXDJBB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6663,2198,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NGJFTIGDSFYTPY-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-11-7(12)3-5-6(4-15-11)10(14-2)16-9(13)8(5)11/h5-8,10,12H,3-4H2,1-2H3",COC1OC(=O)C2C3CC(O)C2(C)OCC13,C11H16O5,pos_1_1proton1ammonium,228.099773612,NGJFTIGDSFYTPY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6664,2197,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_sodium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,2,9.0 6665,2197,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_sodium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,2,9.0 6666,2196,-1,,,,0.24868736,ISDB,ATQGYQHJFMZNGI-HPMQQCADSA-N,"InChI=1S/C13H19NO5/c1-7-10(15)11(16)12(17)13(18-7)19-9-5-3-2-4-8(9)6-14/h2-5,7,10-13,15-17H,6,14H2,1H3/t7-,10-,11+,12+,13-/m0/s1",C[C@@H]1O[C@@H](Oc2ccccc2CN)[C@H](O)[C@H](O)[C@H]1O,C13H19NO5,,269.126322708,ATQGYQHJFMZNGI,Shikimates and Phenylpropanoids,,,Reseda odorata,359611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Resedaceae'],['Unknown'],['Reseda'],['Reseda odorata'],4,0,4.994749426841736 6667,2194,-1,,,,0.0,MS1_match,RUVINXPYWBROJD-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3",CC=Cc1ccc(OC)cc1,C10H12O,pos_1_1proton,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6668,2193,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.22533542,ISDB,QFDYIDGUKXRPKH-VSLGLSMXSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,42H,6-7,9,11-13,18-19,24-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC,C44H78NO8P,,779.546505086,QFDYIDGUKXRPKH,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,3.401341676712036 6669,2193,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.22533542,ISDB,QFDYIDGUKXRPKH-VSLGLSMXSA-N,"InChI=1S/C44H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,42H,6-7,9,11-13,18-19,24-41H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-/t42-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC,C44H78NO8P,,779.546505086,QFDYIDGUKXRPKH,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,3.401341676712036 6670,2191,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_sodium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 6671,2191,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_sodium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 6672,2189,162,,,,0.21134672,ISDB,,,,,,,BMNRKKFJIDDAOJ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8453868627548218 6673,2188,-1,,,,0.0,MS1_match,GZUMIASHHVEXKZ-CPEPOEHTSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)48-34-24-33-32(30(5)37(34)49-44)14-15-35-41(33,8)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3/t28-,31+,35+,36+,39+,40+,41-,42+,43-,44+,45+/m0/s1",C=C(C)[C@@H]1CC[C@H](C)[C@]23CC=C(C)[C@@]2(C1)Oc1cc2c(c(C)c1O3)C=C[C@@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(C(=O)OC)CC[C@]3(C)CC[C@]12C,C45H62O4,pos_2_2proton,666.464810464,GZUMIASHHVEXKZ,Terpenoids,Triterpenoids,Lupane triterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 6674,2188,-1,,,,0.0,MS1_match,GZUMIASHHVEXKZ-UHFFFAOYSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)48-34-24-33-32(30(5)37(34)49-44)14-15-35-41(33,8)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3",C=C(C)C1CCC(C)C23CC=C(C)C2(C1)Oc1cc2c(c(C)c1O3)C=CC1C2(C)CCC2(C)C3CC(C)(C(=O)OC)CCC3(C)CCC12C,C45H62O4,pos_2_2proton,666.464810464,GZUMIASHHVEXKZ,Terpenoids,Triterpenoids,Lupane triterpenoids,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 6675,2188,-1,,,,0.0,MS1_match,GZUMIASHHVEXKZ-WESYEVCFSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)48-34-24-33-32(30(5)37(34)49-44)14-15-35-41(33,8)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3/t28?,31?,35?,36?,39-,40-,41+,42-,43+,44+,45+/m1/s1",C=C(C)C1CCC(C)[C@@]23CC=C(C)[C@]2(C1)Oc1cc2c(c(C)c1O3)C=CC1[C@@]2(C)CC[C@@]2(C)C3C[C@](C)(C(=O)OC)CC[C@]3(C)CC[C@]12C,C45H62O4,pos_2_2proton,666.464810464,GZUMIASHHVEXKZ,Terpenoids,Triterpenoids,Lupane triterpenoids,Cheiloclinium hippocrateoides,6093280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Cheiloclinium'],['Cheiloclinium hippocrateoides'],6,0,6.0 6676,2188,-1,,,,0.0,MS1_match,GZUMIASHHVEXKZ-CPEPOEHTSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)48-34-24-33-32(30(5)37(34)49-44)14-15-35-41(33,8)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3/t28-,31+,35+,36+,39+,40+,41-,42+,43-,44+,45+/m0/s1",C=C(C)[C@@H]1CC[C@H](C)[C@]23CC=C(C)[C@@]2(C1)Oc1cc2c(c(C)c1O3)C=C[C@@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(C(=O)OC)CC[C@]3(C)CC[C@]12C,C45H62O4,pos_2_2proton,666.464810464,GZUMIASHHVEXKZ,Terpenoids,Triterpenoids,Lupane triterpenoids,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 6677,2188,-1,,,,0.0,MS1_match,GZUMIASHHVEXKZ-UHFFFAOYSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)48-34-24-33-32(30(5)37(34)49-44)14-15-35-41(33,8)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3",C=C(C)C1CCC(C)C23CC=C(C)C2(C1)Oc1cc2c(c(C)c1O3)C=CC1C2(C)CCC2(C)C3CC(C)(C(=O)OC)CCC3(C)CCC12C,C45H62O4,pos_2_2proton,666.464810464,GZUMIASHHVEXKZ,Terpenoids,Triterpenoids,Lupane triterpenoids,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 6678,2188,-1,,,,0.0,MS1_match,YCBLLXLXUDSMOB-XUZJJXACSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)49-37-30(5)32-14-15-35-41(8,33(32)24-34(37)48-44)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3/t28-,31+,35-,36-,39-,40-,41+,42-,43+,44-,45-/m1/s1",C=C(C)[C@H]1CC[C@@H](C)[C@]23CC=C(C)[C@@]2(C1)Oc1c(cc2c(c1C)C=C[C@@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]4C[C@](C)(C(=O)OC)CC[C@]4(C)CC[C@]12C)O3,C45H62O4,pos_2_2proton,666.464810464,YCBLLXLXUDSMOB,Terpenoids,Triterpenoids,Lupane triterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 6679,2188,-1,,,,0.0,MS1_match,YCBLLXLXUDSMOB-UHFFFAOYSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)49-37-30(5)32-14-15-35-41(8,33(32)24-34(37)48-44)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3",C=C(C)C1CCC(C)C23CC=C(C)C2(C1)Oc1c(cc2c(c1C)C=CC1C2(C)CCC2(C)C4CC(C)(C(=O)OC)CCC4(C)CCC12C)O3,C45H62O4,pos_2_2proton,666.464810464,YCBLLXLXUDSMOB,Terpenoids,Triterpenoids,Lupane triterpenoids,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 6680,2188,-1,,,,0.0,MS1_match,YCBLLXLXUDSMOB-YBEIIDNDSA-N,"InChI=1S/C45H62O4/c1-27(2)31-13-12-28(3)44-17-16-29(4)45(44,25-31)49-37-30(5)32-14-15-35-41(8,33(32)24-34(37)48-44)21-23-43(10)36-26-40(7,38(46)47-11)19-18-39(36,6)20-22-42(35,43)9/h14-16,24,28,31,35-36H,1,12-13,17-23,25-26H2,2-11H3/t28?,31?,35?,36?,39-,40-,41+,42-,43+,44-,45-/m1/s1",C=C(C)C1CCC(C)[C@]23CC=C(C)[C@@]2(C1)Oc1c(cc2c(c1C)C=CC1[C@@]2(C)CC[C@@]2(C)C4C[C@](C)(C(=O)OC)CC[C@]4(C)CC[C@]12C)O3,C45H62O4,pos_2_2proton,666.464810464,YCBLLXLXUDSMOB,Terpenoids,Triterpenoids,Lupane triterpenoids,Cheiloclinium hippocrateoides,6093280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Cheiloclinium'],['Cheiloclinium hippocrateoides'],6,0,6.0 6681,2188,-1,,,,0.0,MS1_match,FKVSDMAKVBZPKF-YCPHUMOBSA-N,"InChI=1S/C45H62O4/c1-26(2)29-13-12-27(3)31-23-37-45(10,33(31)22-29)49-38-28(4)30-14-15-35-42(7,32(30)24-34(38)48-37)19-21-44(9)36-25-41(6,39(46)47-11)17-16-40(36,5)18-20-43(35,44)8/h14-15,24,27,29,35-37H,1,12-13,16-23,25H2,2-11H3/t27?,29?,35?,36?,37-,40-,41-,42+,43-,44+,45+/m1/s1",C=C(C)C1CCC(C)C2=C(C1)[C@]1(C)Oc3c(cc4c(c3C)C=CC3[C@@]4(C)CC[C@@]4(C)C5C[C@](C)(C(=O)OC)CC[C@]5(C)CC[C@]34C)O[C@@H]1C2,C45H62O4,pos_2_2proton,666.464810464,FKVSDMAKVBZPKF,Terpenoids,Triterpenoids,Lupane triterpenoids,Cheiloclinium hippocrateoides,6093280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Cheiloclinium'],['Cheiloclinium hippocrateoides'],6,0,6.0 6682,2188,-1,,,,0.0,MS1_match,RVCDVYKZKPGMKW-AFYBDMPDSA-N,"InChI=1S/C45H62O4/c1-26(2)29-13-12-27(3)31-23-37-45(10,33(31)22-29)49-34-24-32-30(28(4)38(34)48-37)14-15-35-42(32,7)19-21-44(9)36-25-41(6,39(46)47-11)17-16-40(36,5)18-20-43(35,44)8/h14-15,24,27,29,35-37H,1,12-13,16-23,25H2,2-11H3/t27?,29?,35?,36?,37-,40+,41+,42-,43+,44-,45+/m0/s1",C=C(C)C1CCC(C)C2=C(C1)[C@@]1(C)Oc3cc4c(c(C)c3O[C@H]1C2)C=CC1[C@@]4(C)CC[C@@]2(C)C3C[C@](C)(C(=O)OC)CC[C@]3(C)CC[C@]12C,C45H62O4,pos_2_2proton,666.464810464,RVCDVYKZKPGMKW,Terpenoids,Triterpenoids,Lupane triterpenoids,Cheiloclinium hippocrateoides,6093280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Cheiloclinium'],['Cheiloclinium hippocrateoides'],6,0,6.0 6683,2182,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7253653,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Piper philippinum,290828.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper nudibaccatum'],4,3,8.401461124420166 6684,2182,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7253653,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Scrophularia buergeriana,764427.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Scrophularia'],['Scrophularia buergeriana'],4,3,8.401461124420166 6685,2182,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7253653,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Gmelina asiatica,3883027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Gmelina'],['Gmelina asiatica'],4,3,8.401461124420166 6686,2182,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7253653,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Sideritis infernalis,218370.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis infernalis'],4,3,8.401461124420166 6687,2182,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7253653,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Philotheca obovalis,6126545.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Philotheca'],['Philotheca obovalis'],4,3,8.401461124420166 6688,2182,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7253653,ISDB,VEZIKIAGFYZTCI-YVMONPNESA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3/b8-5-",COC(=O)/C=C\c1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Haplophyllum latifolium,762596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum latifolium'],4,3,8.401461124420166 6689,2180,-1,,,,0.0,MS1_match,YVZJSSFXXNLBHY-LNBDOPGKSA-N,"InChI=1S/C48H78O16/c1-9-26-32(51)35(54)37(56)40(61-26)62-27-21-59-41(38(33(27)52)64-39-36(55)34(53)31(50)23(2)60-39)63-30-13-14-44(5)28(45(30,6)22-49)12-15-47(8)29(44)11-10-24-25-20-43(3,4)16-18-48(25,42(57)58)19-17-46(24,47)7/h10,23,25-41,49-56H,9,11-22H2,1-8H3,(H,57,58)/t23-,25-,26+,27-,28+,29+,30-,31-,32+,33-,34+,35-,36+,37+,38+,39-,40-,41-,44-,45-,46+,47+,48-/m0/s1",CC[C@H]1O[C@@H](O[C@H]2CO[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C48H78O16,pos_2_1proton1potassium,910.528986416,YVZJSSFXXNLBHY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone taipaiensis,6131031.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone taipaiensis'],7,0,7.0 6690,2179,170,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.61882484,ISDB,,,,,,,JFQHGWIDLBBFDM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.47529935836792 6691,2178,-1,,,,0.0,MS1_match,DTUQWGWMVIHBKE-UHFFFAOYSA-N,"InChI=1S/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H2",O=CCc1ccccc1,C8H8O,pos_1_1proton1methanol,120.057514876,DTUQWGWMVIHBKE,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6692,2177,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DAUAQNGYDSHRET-UHFFFAOYSA-N,"InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)",COc1ccc(C(=O)O)cc1OC,C9H10O4,pos_2MH,182.0579088,DAUAQNGYDSHRET,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,0,6.0 6693,2177,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GPVDHNVGGIAOQT-UHFFFAOYSA-N,"InChI=1S/C9H10O4/c1-12-6-3-4-7(9(10)11)8(5-6)13-2/h3-5H,1-2H3,(H,10,11)",COc1ccc(C(=O)O)c(OC)c1,C9H10O4,pos_2MH,182.0579088,GPVDHNVGGIAOQT,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 6694,2176,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.59111387,ISDB,IHEBZQKYPSMVBZ-UHFFFAOYSA-N,"InChI=1S/C10H8O2/c1-7-5-12-6-10-8(4-11)2-3-9(7)10/h2-6H,1H3",Cc1cocc2c(C=O)ccc1-2,C10H8O2,,160.052429496,IHEBZQKYPSMVBZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Viburnum tinus,51742.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum tinus'],5,0,7.364455461502075 6695,2176,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.59111387,ISDB,IHEBZQKYPSMVBZ-UHFFFAOYSA-N,"InChI=1S/C10H8O2/c1-7-5-12-6-10-8(4-11)2-3-9(7)10/h2-6H,1H3",Cc1cocc2c(C=O)ccc1-2,C10H8O2,,160.052429496,IHEBZQKYPSMVBZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Viburnum opulus,117453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum opulus'],5,0,7.364455461502075 6696,2175,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5246063,ISDB,WGPMCTNBJPAHNW-UHFFFAOYSA-N,"InChI=1S/C24H38O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3",CC1=CC(=O)CC(C)(C)C1(O)C=CC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O,C24H38O12,,518.236326656,WGPMCTNBJPAHNW,Terpenoids,Apocarotenoids,Megastigmanes,Albizia julibrissin,39517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Albizia'],['Albizia julibrissin'],4,2,7.0984251499176025 6697,2175,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5246063,ISDB,WGPMCTNBJPAHNW-BYOLIVPTSA-N,"InChI=1S/C24H38O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3/b6-5+/t13-,15-,16-,17+,18-,19+,20+,21-,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O12,,518.236326656,WGPMCTNBJPAHNW,Terpenoids,Apocarotenoids,Megastigmanes,Cydonia oblonga,941743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Cydonia'],['Cydonia oblonga'],4,2,7.0984251499176025 6698,2175,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5246063,ISDB,WGPMCTNBJPAHNW-BYOLIVPTSA-N,"InChI=1S/C24H38O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3/b6-5+/t13-,15-,16-,17+,18-,19+,20+,21-,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O12,,518.236326656,WGPMCTNBJPAHNW,Terpenoids,Apocarotenoids,Megastigmanes,Cydonia vulgaris,316549.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Chaenomeles'],['Chaenomeles sinensis'],4,2,7.0984251499176025 6699,2175,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5246063,ISDB,WGPMCTNBJPAHNW-QZYKCYMZSA-N,"InChI=1S/C24H38O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3/b6-5+/t13-,15-,16-,17+,18-,19+,20-,21-,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O12,,518.2363266559997,WGPMCTNBJPAHNW,Terpenoids,Apocarotenoids,Megastigmanes,Garcinia hombroniana,724102.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia hombroniana'],4,2,7.0984251499176025 6700,2175,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5246063,ISDB,WGPMCTNBJPAHNW-QZYKCYMZSA-N,"InChI=1S/C24H38O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3/b6-5+/t13-,15-,16-,17+,18-,19+,20-,21-,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O12,,518.2363266559997,WGPMCTNBJPAHNW,Terpenoids,Apocarotenoids,Megastigmanes,Garcinia celebica,729746.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia celebica'],4,2,7.0984251499176025 6701,2175,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5246063,ISDB,WGPMCTNBJPAHNW-UHFFFAOYSA-N,"InChI=1S/C24H38O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3",CC1=CC(=O)CC(C)(C)C1(O)C=CC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O,C24H38O12,,518.236326656,WGPMCTNBJPAHNW,Terpenoids,Apocarotenoids,Megastigmanes,Eriobotrya japonica,207983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Eriobotrya'],['Eriobotrya japonica'],4,2,7.0984251499176025 6702,2175,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5246063,ISDB,WGPMCTNBJPAHNW-QZYKCYMZSA-N,"InChI=1S/C24H38O12/c1-12-7-14(26)8-22(3,4)24(12,32)6-5-13(2)35-20-18(29)17(28)16(27)15(36-20)9-33-21-19(30)23(31,10-25)11-34-21/h5-7,13,15-21,25,27-32H,8-11H2,1-4H3/b6-5+/t13-,15-,16-,17+,18-,19+,20-,21-,23-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O12,,518.2363266559997,WGPMCTNBJPAHNW,Terpenoids,Apocarotenoids,Megastigmanes,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,2,7.0984251499176025 6703,2174,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,ZJSJQWDXAYNLNS-FUPWJLLWSA-N,"InChI=1S/C32H42O16/c1-41-19-7-13(3-5-17(19)45-31-27(39)25(37)23(35)21(9-33)47-31)29-15-11-44-30(16(15)12-43-29)14-4-6-18(20(8-14)42-2)46-32-28(40)26(38)24(36)22(10-34)48-32/h3-8,15-16,21-40H,9-12H2,1-2H3/t15-,16-,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H42O16,pos_1_1proton1ammonium,682.2472852640001,ZJSJQWDXAYNLNS,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,9.0 6704,2174,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,ZJSJQWDXAYNLNS-FUPWJLLWSA-N,"InChI=1S/C32H42O16/c1-41-19-7-13(3-5-17(19)45-31-27(39)25(37)23(35)21(9-33)47-31)29-15-11-44-30(16(15)12-43-29)14-4-6-18(20(8-14)42-2)46-32-28(40)26(38)24(36)22(10-34)48-32/h3-8,15-16,21-40H,9-12H2,1-2H3/t15-,16-,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H42O16,pos_1_1proton1ammonium,682.2472852640001,ZJSJQWDXAYNLNS,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,9.0 6705,2172,340,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.744033,ISDB,RYFIRWYAAYKJJZ-YFOZGACTSA-N,"InChI=1S/C36H36O18/c1-14-33(54-36-31(47)28(44)26(42)23(53-36)13-49-24(41)9-3-15-2-8-19(38)20(39)10-15)30(46)32(48)35(50-14)51-18-11-21(40)25-22(12-18)52-34(29(45)27(25)43)16-4-6-17(37)7-5-16/h2-12,14,23,26,28,30-33,35-40,42,44-48H,13H2,1H3/b9-3+/t14-,23+,26+,28-,30-,31+,32+,33-,35-,36-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O,C36H36O18,,756.190164312,RYFIRWYAAYKJJZ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rorippa indica,341724.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Cardamineae'],['Rorippa'],['Rorippa indica'],4,3,8.476131916046143 6706,2167,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AOHQEWBMTRLCSX-UHFFFAOYSA-N,"InChI=1S/C16H28O7/c1-15(2)7-4-10(16(15,3)5-8(7)18)23-14-13(21)12(20)11(19)9(6-17)22-14/h7-14,17-21H,4-6H2,1-3H3",CC1(C)C2CC(OC3OC(CO)C(O)C(O)C3O)C1(C)CC2O,C16H28O7,pos_1_sodium,332.1835032359999,AOHQEWBMTRLCSX,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6707,2167,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,OCDWKDASQKOTIQ-UHFFFAOYSA-N,"InChI=1S/C16H28O7/c1-15-4-3-8(16(15,2)7-18)5-10(15)23-14-13(21)12(20)11(19)9(6-17)22-14/h8-14,17-21H,3-7H2,1-2H3",CC1(CO)C2CCC1(C)C(OC1OC(CO)C(O)C(O)C1O)C2,C16H28O7,pos_1_sodium,332.183503236,OCDWKDASQKOTIQ,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6708,2166,-1,,,,0.45651194,ISDB,MZSZEFRWURPSJY-JNWWKETESA-N,"InChI=1S/C16H17NO8/c1-5(18)25-15-12(19)10-6-2-8-9(24-4-23-8)3-7(6)16(22)17-11(10)13(20)14(15)21/h2-3,10-15,19-21H,4H2,1H3,(H,17,22)/t10-,11-,12-,13+,14+,15+/m1/s1",CC(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H]2NC(=O)c3cc4c(cc3[C@H]2[C@H]1O)OCO4,C16H17NO8,,351.095416504,MZSZEFRWURPSJY,Alkaloids,Tyrosine alkaloids,Amarylidaceae alkaloids,Amaryllidaceae,17701.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Unknown'],['Unknown'],['Unknown'],4,0,5.826047778129578 6709,2165,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,ZYGHJZDHTFUPRJ-UHFFFAOYSA-N,InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,O=c1ccc2ccccc2o1,C9H6O2,pos_1_1proton,146.036779432,ZYGHJZDHTFUPRJ,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,3,7.5 6710,2164,170,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,OSEQXWIIKWMXMK-NWPPUUMPSA-N,"InChI=1S/C33H43NO9/c1-17(35)43-32-14-22(39-4)20-13-21(24(32)26(20)42-30(36)18-7-9-19(38-3)10-8-18)33-23(40-5)11-12-31(16-37-2)15-34-29(33)25(32)27(41-6)28(31)33/h7-10,15,20-29H,11-14,16H2,1-6H3/t20-,21-,22+,23+,24-,25+,26+,27+,28-,29-,31+,32-,33+/m1/s1",COC[C@]12C=N[C@@H]3[C@@H]4[C@H](OC)[C@H]1[C@@]3([C@@H](OC)CC2)[C@@H]1C[C@H]2[C@H](OC(=O)c3ccc(OC)cc3)[C@@H]1[C@]4(OC(C)=O)C[C@@H]2OC,C33H43NO9,pos_2_2proton1acetonitrile,597.293781956,OSEQXWIIKWMXMK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum macrorhynchum,7591226.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum macrorhynchum'],6,1,6.5 6711,2163,330,Terpenoids,Monoterpenoids,Pinane monoterpenoids,0.40167567,ISDB,AXBUFJCSFBHIIY-PYIBUYJLSA-N,"InChI=1S/C21H38O9/c1-6-21(5,28)10-13(9-12(2)7-8-15(23)20(3,4)27)29-19-18(26)17(25)16(24)14(11-22)30-19/h6,9,13-19,22-28H,1,7-8,10-11H2,2-5H3/b12-9+/t13-,14-,15-,16-,17+,18-,19-,21-/m1/s1",C=C[C@@](C)(O)C[C@@H](/C=C(\C)CC[C@@H](O)C(C)(C)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H38O9,,434.251582796,AXBUFJCSFBHIIY,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Saussurea triangulata,3894833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Saussurea'],['Saussurea triangulata'],4,2,6.60670268535614 6712,2160,686,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MWLKXILGJPSPKZ-LWSBBEHMSA-N,"InChI=1S/C34H46O19/c1-5-15-17(18(29(44)46-3)12-48-31(15)52-33-27(42)25(40)23(38)20(10-36)50-33)8-7-14(9-35)22-16(6-2)32(49-13-19(22)30(45)47-4)53-34-28(43)26(41)24(39)21(11-37)51-34/h5-7,9,12-13,15-17,20-28,31-34,36-43H,1-2,8,10-11H2,3-4H3/b14-7+/t15-,16-,17+,20-,21-,22+,23-,24-,25+,26+,27-,28-,31+,32+,33+,34+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C/C=C(\C=O)[C@@H]1C(C(=O)OC)=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1C=C,C34H46O19,pos_1_1proton1ammonium,758.263329252,MWLKXILGJPSPKZ,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6713,2160,686,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MWLKXILGJPSPKZ-UHFFFAOYSA-N,"InChI=1S/C34H46O19/c1-5-15-17(18(29(44)46-3)12-48-31(15)52-33-27(42)25(40)23(38)20(10-36)50-33)8-7-14(9-35)22-16(6-2)32(49-13-19(22)30(45)47-4)53-34-28(43)26(41)24(39)21(11-37)51-34/h5-7,9,12-13,15-17,20-28,31-34,36-43H,1-2,8,10-11H2,3-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=C(C=O)C1C(C(=O)OC)=COC(OC2OC(CO)C(O)C(O)C2O)C1C=C,C34H46O19,pos_1_1proton1ammonium,758.263329252,MWLKXILGJPSPKZ,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 6714,2159,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HOCKGUMMVOPFFC-RHMPUOGUSA-N,"InChI=1S/C21H34O12/c1-9(2)3-14(25)33-19-15-11(4-13(24)21(15,29)8-23)10(6-30-19)7-31-20-18(28)17(27)16(26)12(5-22)32-20/h6,9,11-13,15-20,22-24,26-29H,3-5,7-8H2,1-2H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@](O)(CO)[C@@H]12,C21H34O12,pos_1_1proton1ammonium,478.2050265279999,HOCKGUMMVOPFFC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6715,2158,877,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.30939513,ISDB,OJGKTHCXUFNMIQ-MMPACCRQSA-N,"InChI=1S/C13H24O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-6,9-11,14-16H,7-8H2,1-4H3/b6-5+/t9-,10-,11+,13-/m1/s1",C[C@@H]1C[C@H](O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O,C13H24O3,,228.172544628,OJGKTHCXUFNMIQ,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Helianthus annuus,515712.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Helianthus'],['Helianthus annuus'],4,3,6.7375805377960205 6716,2158,877,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.30939513,ISDB,OJGKTHCXUFNMIQ-MMPACCRQSA-N,"InChI=1S/C13H24O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-6,9-11,14-16H,7-8H2,1-4H3/b6-5+/t9-,10-,11+,13-/m1/s1",C[C@@H]1C[C@H](O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O,C13H24O3,,228.172544628,OJGKTHCXUFNMIQ,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Alangium premnifolium,6045450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Cornaceae'],['Unknown'],['Alangium'],['Alangium premnifolium'],4,3,6.7375805377960205 6717,2158,877,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.30939513,ISDB,OJGKTHCXUFNMIQ-NSJQKUIWSA-N,"InChI=1S/C13H24O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-6,9-11,14-16H,7-8H2,1-4H3/b6-5+/t9-,10-,11+,13+/m1/s1",C[C@@H]1C[C@H](O)CC(C)(C)[C@]1(O)/C=C/[C@@H](C)O,C13H24O3,,228.172544628,OJGKTHCXUFNMIQ,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Mikania hirsutissima,7051520.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Mikania'],['Mikania hirsutissima'],4,3,6.7375805377960205 6718,2158,877,Terpenoids,Apocarotenoids,Apocarotenoids (β-),0.30939513,ISDB,OJGKTHCXUFNMIQ-NSJQKUIWSA-N,"InChI=1S/C13H24O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-6,9-11,14-16H,7-8H2,1-4H3/b6-5+/t9-,10-,11+,13+/m1/s1",C[C@@H]1C[C@H](O)CC(C)(C)[C@]1(O)/C=C/[C@@H](C)O,C13H24O3,,228.172544628,OJGKTHCXUFNMIQ,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Mikania banisteriae,7051520.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Mikania'],['Mikania hirsutissima'],4,3,6.7375805377960205 6719,2156,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,WVDDGKGOMKODPV-UHFFFAOYSA-N,"InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2",OCc1ccccc1,C7H8O,pos_2MHNH3,108.057514876,WVDDGKGOMKODPV,Shikimates and Phenylpropanoids,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6720,2156,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,OXZSUQJHKQOGOK-UHFFFAOYSA-N,"InChI=1S/C12H16O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5-8H,1-4H3",CC(=O)Oc1cc(C(C)C)ccc1C,C12H16O2,pos_1_1proton1acetonitrile,192.115029752,OXZSUQJHKQOGOK,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 6721,2155,861,Shikimates and Phenylpropanoids,Aromatic polyketides,Griseofulvins,0.4769759,ISDB,ITENTBHADJNDDH-DJTMHQFBSA-N,"InChI=1S/C16H16O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,19,21,24H,6-7H2,(H,22,23)/b4-2-/t11-,12-,14+,16-/m1/s1",O=C(/C=C\C1=CC(=O)C(=O)C=C1)O[C@@H]1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,C16H16O9,,352.079432092,ITENTBHADJNDDH,Shikimates and Phenylpropanoids,,,Cynara cardunculus,991885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Cynara'],['Cynara cardunculus'],4,1,6.407903552055359 6722,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,3,7.5 6723,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lepuropetalon spathulatum,78653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lepuropetalon'],['Lepuropetalon spathulatum'],6,3,7.5 6724,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,3,7.5 6725,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,3,7.5 6726,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,3,7.5 6727,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,3,7.5 6728,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,3,7.5 6729,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,3,7.5 6730,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-UHFFFAOYSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3",CC1OC(OCC2OC(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)C(O)C(O)C2O)C(O)C(O)C1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,3,7.5 6731,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-KYGWAIEOSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18-,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,3,7.5 6732,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus hindsii,709258.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hindsii'],6,3,7.5 6733,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GXLQUHPXGLZNGE-UHFFFAOYSA-N,"InChI=1S/C27H30O15/c1-8-17(31)20(34)22(36)26(38-8)40-11-6-14(30)16-15(7-11)41-24(10-3-4-12(28)13(29)5-10)25(19(16)33)42-27-23(37)21(35)18(32)9(2)39-27/h3-9,17-18,20-23,26-32,34-37H,1-2H3",CC1OC(Oc2cc(O)c3c(=O)c(OC4OC(C)C(O)C(O)C4O)c(-c4ccc(O)c(O)c4)oc3c2)C(O)C(O)C1O,C27H30O15,pos_2_1proton1potassium,594.15847026,GXLQUHPXGLZNGE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 6734,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GXLQUHPXGLZNGE-BJBZVNFPSA-N,"InChI=1S/C27H30O15/c1-8-17(31)20(34)22(36)26(38-8)40-11-6-14(30)16-15(7-11)41-24(10-3-4-12(28)13(29)5-10)25(19(16)33)42-27-23(37)21(35)18(32)9(2)39-27/h3-9,17-18,20-23,26-32,34-37H,1-2H3/t8-,9-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.15847026,GXLQUHPXGLZNGE,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Elaeodendron xylocarpum,806635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Elaeodendron'],['Elaeodendron xylocarpum'],6,3,7.5 6735,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OHOBPOYHROOXEI-SRIOWEGGSA-N,"InChI=1S/C27H30O15/c1-9-17(32)20(35)22(37)26(38-9)42-25-21(36)18(33)15(8-28)40-27(25)41-24-19(34)16-13(31)6-12(30)7-14(16)39-23(24)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,25-33,35-37H,8H2,1H3/t9-,15+,17-,18-,20+,21-,22+,25+,26-,27-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.1584702600001,OHOBPOYHROOXEI,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,3,7.5 6736,2154,1145,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OHOBPOYHROOXEI-SRIOWEGGSA-N,"InChI=1S/C27H30O15/c1-9-17(32)20(35)22(37)26(38-9)42-25-21(36)18(33)15(8-28)40-27(25)41-24-19(34)16-13(31)6-12(30)7-14(16)39-23(24)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,25-33,35-37H,8H2,1H3/t9-,15+,17-,18-,20+,21-,22+,25+,26-,27-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)O[C@H](CO)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_2_1proton1potassium,594.1584702600001,OHOBPOYHROOXEI,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,3,7.5 6737,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,3,7.5 6738,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,3,7.5 6739,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 6740,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,MTGTYFYLZVUKQG-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O10,pos_1_1proton,418.0899967759999,MTGTYFYLZVUKQG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 6741,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,NIDSBIYSGNHVDL-UHFFFAOYSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)",O=C(C=Cc1ccc(O)cc1)OC(C(=O)O)C(O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,3,7.5 6742,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,3,7.5 6743,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 6744,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 6745,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 6746,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,3,7.5 6747,2153,1712,Shikimates and Phenylpropanoids,Flavonoids,Cinnamic acids and derivatives,0.0,MS1_match,NIDSBIYSGNHVDL-ZUVWSUMTSA-N,"InChI=1S/C20H18O10/c21-13-5-1-11(2-6-13)4-8-16(24)30-17(18(25)26)20(29,19(27)28)10-12-3-7-14(22)15(23)9-12/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O,C20H18O10,pos_1_1proton,418.089996776,NIDSBIYSGNHVDL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 6748,2152,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,AXCXHFKZHDEKTP-UHFFFAOYSA-N,"InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3",COc1ccc(C=CC=O)cc1,C10H10O2,pos_1_1proton,162.06807956,AXCXHFKZHDEKTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,1,6.5 6749,2151,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7726514,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya paniculata,81668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya paniculata'],4,3,8.59060549736023 6750,2151,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.7726514,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya exotica,755734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya exotica'],4,3,8.59060549736023 6751,2149,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6752,2149,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6753,2149,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6754,2149,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6755,2149,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6756,2149,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_1proton1ammonium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 6757,2146,-1,,,,0.0,MS1_match,ODDNJYHUVXKJBI-SQLGEJSKSA-N,"InChI=1S/C15H28O3/c1-13(2,17)10-5-7-14(3)11(9-10)15(4,18)8-6-12(14)16/h10-12,16-18H,5-9H2,1-4H3/t10-,11+,12+,14+,15+/m1/s1",CC(C)(O)[C@@H]1CC[C@]2(C)[C@@H](O)CC[C@](C)(O)[C@H]2C1,C15H28O3,pos_2MNa,256.203844756,ODDNJYHUVXKJBI,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 6758,2146,-1,,,,0.0,MS1_match,ODDNJYHUVXKJBI-SQLGEJSKSA-N,"InChI=1S/C15H28O3/c1-13(2,17)10-5-7-14(3)11(9-10)15(4,18)8-6-12(14)16/h10-12,16-18H,5-9H2,1-4H3/t10-,11+,12+,14+,15+/m1/s1",CC(C)(O)[C@@H]1CC[C@]2(C)[C@@H](O)CC[C@](C)(O)[C@H]2C1,C15H28O3,pos_2MNa,256.203844756,ODDNJYHUVXKJBI,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.0 6759,2146,-1,,,,0.0,MS1_match,OCOXBRHAPZDTPL-UHFFFAOYSA-N,"InChI=1S/C15H28O3/c1-10-5-6-12(16)15(18)8-7-11(13(2,3)17)9-14(10,15)4/h10-12,16-18H,5-9H2,1-4H3",CC1CCC(O)C2(O)CCC(C(C)(C)O)CC12C,C15H28O3,pos_2MNa,256.203844756,OCOXBRHAPZDTPL,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6760,2145,-1,,,,0.5072242,ISDB,FFZDJCBPACTOIH-UHFFFAOYSA-N,"InChI=1S/C15H17NO6/c1-9(15(20)12(21-2)7-13(17)22-15)8-16-11-5-3-10(4-6-11)14(18)19/h3-7,9,16,20H,8H2,1-2H3,(H,18,19)",COC1=CC(=O)OC1(O)C(C)CNc1ccc(C(=O)O)cc1,C15H17NO6,,307.105587264,FFZDJCBPACTOIH,Shikimates and Phenylpropanoids,,,Aspergillus ochraceus,283734.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus ochraceus'],1,0,3.0288968086242676 6761,2142,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.33317453,ISDB,HFPZCAJZSCWRBC-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3",Cc1ccc(C(C)C)cc1,C10H14,,134.109550448,HFPZCAJZSCWRBC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.832698106765747 6762,2140,-1,,,,0.4105776,ISDB,JNKJMYDDORVXSD-AATRIKPKSA-N,"InChI=1S/C13H15NO5/c1-3-4-5-6-7-9(15)10(16)8-11(19-7)13(2,18)14-12(8)17/h5-6,15,18H,3-4H2,1-2H3,(H,14,17)/b6-5+",CCC/C=C/c1oc2c(c(=O)c1O)C(=O)NC2(C)O,C13H15NO5,,265.09502258,JNKJMYDDORVXSD,Polyketides,,,Aspergillus spinulosus,5310629.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus spinulosus'],1,0,2.642310380935669 6763,2138,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.22035235,ISDB,ILUJQPXNXACGAN-UHFFFAOYSA-N,"InChI=1S/C8H8O3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H,9,10)",COc1ccccc1C(=O)O,C8H8O3,,152.047344116,ILUJQPXNXACGAN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.881409406661987 6764,2136,272,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,0.0,MS1_match,ZDVZKBOFCHOPLM-DEYYWGMASA-N,"InChI=1S/C22H28O8/c1-27-15-7-12(8-16(28-2)20(15)25)18-14(10-24)13(9-23)5-11-6-17(29-3)21(26)22(30-4)19(11)18/h6-8,13-14,18,23-26H,5,9-10H2,1-4H3/t13-,14-,18-/m0/s1",COc1cc([C@@H]2c3c(cc(OC)c(O)c3OC)C[C@@H](CO)[C@@H]2CO)cc(OC)c1O,C22H28O8,pos_2_2proton,420.1784178559999,ZDVZKBOFCHOPLM,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,8.5 6765,2136,272,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,0.0,MS1_match,ZDVZKBOFCHOPLM-DEYYWGMASA-N,"InChI=1S/C22H28O8/c1-27-15-7-12(8-16(28-2)20(15)25)18-14(10-24)13(9-23)5-11-6-17(29-3)21(26)22(30-4)19(11)18/h6-8,13-14,18,23-26H,5,9-10H2,1-4H3/t13-,14-,18-/m0/s1",COc1cc([C@@H]2c3c(cc(OC)c(O)c3OC)C[C@@H](CO)[C@@H]2CO)cc(OC)c1O,C22H28O8,pos_2_2proton,420.1784178559999,ZDVZKBOFCHOPLM,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,8.5 6766,2136,272,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,0.0,MS1_match,ZDVZKBOFCHOPLM-DEYYWGMASA-N,"InChI=1S/C22H28O8/c1-27-15-7-12(8-16(28-2)20(15)25)18-14(10-24)13(9-23)5-11-6-17(29-3)21(26)22(30-4)19(11)18/h6-8,13-14,18,23-26H,5,9-10H2,1-4H3/t13-,14-,18-/m0/s1",COc1cc([C@@H]2c3c(cc(OC)c(O)c3OC)C[C@@H](CO)[C@@H]2CO)cc(OC)c1O,C22H28O8,pos_2_2proton,420.1784178559999,ZDVZKBOFCHOPLM,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,8.5 6767,2134,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.3775057,ISDB,HFPZCAJZSCWRBC-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3",Cc1ccc(C(C)C)cc1,C10H14,,134.109550448,HFPZCAJZSCWRBC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,9.010022759437561 6768,2128,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.95128596,ISDB,,,,,,,UMXDJWMIEHQSHF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.8051438331604004 6769,2127,-1,,,,0.0,MS1_match,DRAPQDCEBKBPQE-ACFZRETJSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(13-4-6-16(29)18(8-13)34-2)26(14,11-36-23)38-25-22(32)21(31)20(30)19(9-27)37-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25+,26-/m1/s1",COc1cc([C@H]2OC[C@]3(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O,C26H32O12,pos_2_2sodium,536.1893764639999,DRAPQDCEBKBPQE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6770,2127,-1,,,,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2sodium,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6771,2127,-1,,,,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2sodium,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6772,2127,-1,,,,0.0,MS1_match,GQLQVPZSTWXDBQ-ZOKOZUFBSA-N,"InChI=1S/C26H32O12/c1-33-17-8-13(3-5-15(17)28)24-26(32)11-36-23(14(26)10-35-24)12-4-6-16(18(7-12)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25-,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2sodium,536.1893764639998,GQLQVPZSTWXDBQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 6773,2127,-1,,,,0.0,MS1_match,KPZWNZOLVDRTMM-YRDWWIAGSA-N,"InChI=1S/C26H32O12/c1-33-18-8-13(3-5-16(18)28)23-26(32)11-36-22(15(26)10-35-23)12-4-6-17(19(7-12)34-2)37-25-14(9-27)20(29)21(30)24(31)38-25/h3-8,14-15,20-25,27-32H,9-11H2,1-2H3/t14-,15-,20-,21+,22-,23-,24+,25+,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@H]5O[C@H](O)[C@@H](O)[C@H](O)[C@H]5CO)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2sodium,536.189376464,KPZWNZOLVDRTMM,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 6774,2125,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.3718019,ISDB,KGKIGWBYVVWXME-LLVKDONJSA-N,"InChI=1S/C12H22O4/c1-10(13)7-5-3-2-4-6-8-11(14)9-12(15)16/h11,14H,2-9H2,1H3,(H,15,16)/t11-/m1/s1",CC(=O)CCCCCCC[C@@H](O)CC(=O)O,C12H22O4,,230.151809184,KGKIGWBYVVWXME,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Blepharizonia plumosa,1042864.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Madieae'],['Blepharizonia'],['Blepharizonia plumosa'],4,0,5.487207651138306 6775,2123,277,Fatty acids,Octadecanoids,Jasmonic acids,0.0,MS1_match,GEWDNTWNSAZUDX-WQMVXFAESA-N,"InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)OC,C13H20O3,pos_1_1proton1acetonitrile,224.1412445,GEWDNTWNSAZUDX,Fatty acids,Octadecanoids,Jasmonic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6776,2122,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.39672086,ISDB,USFDIQKRDRIDPN-CTYIEIGBSA-N,"InChI=1S/C17H22O9/c1-23-10-5-9(3-4-13(19)24-2)6-11(7-10)25-17-16(22)15(21)14(20)12(8-18)26-17/h3-7,12,14-18,20-22H,8H2,1-2H3/b4-3+/t12-,14-,15+,16-,17-/m1/s1",COC(=O)/C=C/c1cc(OC)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,C17H22O9,,370.126382284,USFDIQKRDRIDPN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Linum usitatissimum,1000262.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Linaceae'],['Unknown'],['Linum'],['Linum usitatissimum'],4,3,7.0868834257125854 6777,2120,86,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.8386208,ISDB,WHFHDVDXYKOSKI-UHFFFAOYSA-N,"InChI=1S/C10H12/c1-3-9-5-7-10(4-2)8-6-9/h3,5-8H,1,4H2,2H3",C=Cc1ccc(CC)cc1,C10H12,,132.093900384,WHFHDVDXYKOSKI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Magnolia kobus,664531.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Magnoliaceae'],['Unknown'],['Magnolia'],['Magnolia kobus'],4,3,8.854483127593994 6778,2119,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.32116377,ISDB,UPNWOCRDANTCBA-DUXPYHPUSA-N,"InChI=1S/C19H21NO4/c1-24-18-13-15(7-10-17(18)22)3-2-4-19(23)20-12-11-14-5-8-16(21)9-6-14/h2,4-10,13,21-22H,3,11-12H2,1H3,(H,20,23)/b4-2+",COc1cc(C/C=C/C(=O)NCCc2ccc(O)cc2)ccc1O,C19H21NO4,,327.147058152,UPNWOCRDANTCBA,Amino acids and Peptides,Phenylpropanoids (C6-C3),Cinnamic acid amides,Pisonia aculeata,833114.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Nyctaginaceae'],['Unknown'],['Pisonia'],['Pisonia aculeata'],4,3,6.7846550941467285 6779,2117,849,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_1proton1ammonium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6780,2117,849,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_1proton1ammonium,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 6781,2115,605,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,OCOXBRHAPZDTPL-UHFFFAOYSA-N,"InChI=1S/C15H28O3/c1-10-5-6-12(16)15(18)8-7-11(13(2,3)17)9-14(10,15)4/h10-12,16-18H,5-9H2,1-4H3",CC1CCC(O)C2(O)CCC(C(C)(C)O)CC12C,C15H28O3,pos_2MHNH3,256.203844756,OCOXBRHAPZDTPL,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 6782,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Flavoparmelia springtonensis,870362.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Parmeliaceae'],['Unknown'],['Flavoparmelia'],['Flavoparmelia springtonensis'],1,3,5.585772275924683 6783,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Ramalina siliquosa,607539.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Ramalinaceae'],['Unknown'],['Ramalina'],['Ramalina siliquosa'],1,3,5.585772275924683 6784,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Lepraria eburnea,773243.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Stereocaulaceae'],['Unknown'],['Lepraria'],['Lepraria eburnea'],1,3,5.585772275924683 6785,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Cladonia cryptochlorophaea,3764991.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Cladoniaceae'],['Unknown'],['Cladonia'],['Cladonia cryptochlorophaea'],1,3,5.585772275924683 6786,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Cladonia rei,379483.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Cladoniaceae'],['Unknown'],['Cladonia'],['Cladonia rei'],1,3,5.585772275924683 6787,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Cladonia foliacea,955707.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Cladoniaceae'],['Unknown'],['Cladonia'],['Cladonia foliacea'],1,3,5.585772275924683 6788,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Cladonia convoluta,655908.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Cladoniaceae'],['Unknown'],['Cladonia'],['Cladonia convoluta'],1,3,5.585772275924683 6789,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Flavoparmelia haysomii,91069.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Parmeliaceae'],['Unknown'],['Flavoparmelia'],['Flavoparmelia haysomii'],1,3,5.585772275924683 6790,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Cetraria islandica,305900.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Parmeliaceae'],['Unknown'],['Cetraria'],['Cetraria islandica'],1,3,5.585772275924683 6791,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Cetraria islandica subsp. islandica,516211.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Parmeliaceae'],['Unknown'],['Cetraria'],['Unknown'],1,3,5.585772275924683 6792,2114,288,Polyketides,Aromatic polyketides,Depsidones,0.77144307,ISDB,VOXMONAUSQZPTP-UHFFFAOYSA-N,"InChI=1S/C18H14O9/c1-6-3-10(21)8(4-19)15-11(6)18(25)27-16-9(5-20)13(22)12(17(23)24)7(2)14(16)26-15/h3-4,20-22H,5H2,1-2H3,(H,23,24)",Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2,C18H14O9,,374.0637820279999,VOXMONAUSQZPTP,Polyketides,Aromatic polyketides,Depsidones,Cetraria ericetorum,240839.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Lecanoromycetes'],['Lecanorales'],['Parmeliaceae'],['Unknown'],['Cetraria'],['Cetraria ericetorum'],1,3,5.585772275924683 6793,2111,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZNJFBWYDHIGLCU-HWKXXFMVSA-N,"InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3-/t9-,10-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O,C12H18O3,pos_1_1proton1acetonitrile,210.125594436,ZNJFBWYDHIGLCU,Fatty acids,Octadecanoids,Jasmonic acids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6794,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6795,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 6796,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 6797,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 6798,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 6799,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 6800,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 6801,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_sodium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 6802,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_sodium,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 6803,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_sodium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 6804,2108,736,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_sodium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 6805,2107,560,Terpenoids,Steroids,Pregnane steroids,0.47691658,ISDB,PJDRPKPUOVBEGQ-GYHMJCRDSA-N,"InChI=1S/C21H34O6/c1-11(22)20(26)8-9-21(27)14-5-4-12-10-13(23)6-7-18(12,2)15(14)16(24)17(25)19(20,21)3/h4,11,13-17,22-27H,5-10H2,1-3H3/t11-,13+,14-,15-,16+,17-,18+,19-,20-,21+/m1/s1",C[C@@H](O)[C@]1(O)CC[C@]2(O)[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3[C@H](O)[C@@H](O)[C@]12C,C21H34O6,,382.235538808,PJDRPKPUOVBEGQ,Terpenoids,Steroids,Pregnane steroids,Marsdenia roylei,6067183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Marsdenieae'],['Marsdenia'],['Marsdenia roylei'],4,3,7.407666325569153 6806,2106,812,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.42136812,ISDB,KWMWJQVVNZCVAU-UHFFFAOYSA-N,"InChI=1S/C36H36O17/c1-15-26(42)29(45)31(47)35(49-15)53-34-30(46)27(43)23(14-48-24(41)11-4-16-2-7-18(37)8-3-16)51-36(34)52-33-28(44)25-21(40)12-20(39)13-22(25)50-32(33)17-5-9-19(38)10-6-17/h2-13,15,23,26-27,29-31,34-40,42-43,45-47H,14H2,1H3",CC1OC(OC2C(Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)OC(COC(=O)C=Cc3ccc(O)cc3)C(O)C2O)C(O)C(O)C1O,C36H36O17,,740.1952496920001,KWMWJQVVNZCVAU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Castanea sativa,1028994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Castanea'],['Castanea sativa'],4,3,7.18547248840332 6807,2106,812,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.42136812,ISDB,KWMWJQVVNZCVAU-KTHJHTPKSA-N,"InChI=1S/C36H36O17/c1-15-26(42)29(45)31(47)35(49-15)53-34-30(46)27(43)23(14-48-24(41)11-4-16-2-7-18(37)8-3-16)51-36(34)52-33-28(44)25-21(40)12-20(39)13-22(25)50-32(33)17-5-9-19(38)10-6-17/h2-13,15,23,26-27,29-31,34-40,42-43,45-47H,14H2,1H3/b11-4+/t15-,23+,26-,27+,29+,30-,31+,34+,35-,36-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)O[C@H](COC(=O)/C=C/c3ccc(O)cc3)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C36H36O17,,740.195249692,KWMWJQVVNZCVAU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Oenothera filiformis,623290.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Onagraceae'],['Onagreae'],['Oenothera'],['Oenothera filiformis'],4,3,7.18547248840332 6808,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 6809,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6810,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6811,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_2MNa,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6812,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 6813,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 6814,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 6815,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 6816,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 6817,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 6818,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_2MNa,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 6819,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6820,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 6821,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_2MNa,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 6822,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 6823,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6824,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MNa,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6825,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_2MNa,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6826,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_2MNa,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 6827,2104,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_2MNa,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 6828,2101,1133,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1ammonium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 6829,2101,1133,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1ammonium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 6830,2100,801,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.6253808,ISDB,CFBCZETZIPZOGW-UHFFFAOYSA-N,"InChI=1S/C8H6O2/c9-7-2-1-3-8-6(7)4-5-10-8/h1-5,9H",Oc1cccc2occc12,C8H6O2,,134.036779432,CFBCZETZIPZOGW,Polyketides,,,Lonchocarpus castilloi,3920404.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Millettieae'],['Lonchocarpus'],['Lonchocarpus castilloi'],4,0,6.50152325630188 6831,2099,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_2MNa,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 6832,2099,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_2MNa,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 6833,2098,1135,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.5240214,ISDB,HHSKNLJWHGXWPK-BFMVXSJESA-N,"InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1",O=C(OC[C@H]1O[C@@H](Oc2ccccc2CO)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1,C20H22O8,,390.13146766399984,HHSKNLJWHGXWPK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Populus grandidentata,1035526.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Saliceae'],['Populus'],['Populus grandidentata'],4,3,7.596085548400879 6834,2098,1135,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.5240214,ISDB,HHSKNLJWHGXWPK-BFMVXSJESA-N,"InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1",O=C(OC[C@H]1O[C@@H](Oc2ccccc2CO)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1,C20H22O8,,390.13146766399984,HHSKNLJWHGXWPK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Populus alba,1030862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Saliceae'],['Populus'],['Populus alba'],4,3,7.596085548400879 6835,2098,1135,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.5240214,ISDB,HHSKNLJWHGXWPK-BFMVXSJESA-N,"InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1",O=C(OC[C@H]1O[C@@H](Oc2ccccc2CO)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1,C20H22O8,,390.13146766399984,HHSKNLJWHGXWPK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Populus tremula,839584.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Saliceae'],['Populus'],['Populus tremula'],4,3,7.596085548400879 6836,2098,1135,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.5240214,ISDB,HHSKNLJWHGXWPK-BFMVXSJESA-N,"InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1",O=C(OC[C@H]1O[C@@H](Oc2ccccc2CO)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1,C20H22O8,,390.13146766399984,HHSKNLJWHGXWPK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Populus tremuloides,8858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Saliceae'],['Populus'],['Populus tremuloides'],4,3,7.596085548400879 6837,2098,1135,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.5240214,ISDB,HHSKNLJWHGXWPK-JNIAIEOXSA-N,"InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m0/s1",O=C(OC[C@@H]1O[C@H](Oc2ccccc2CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,C20H22O8,,390.131467664,HHSKNLJWHGXWPK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Prunus grayana,870878.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus grayana'],4,3,7.596085548400879 6838,2098,1135,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.5240214,ISDB,HHSKNLJWHGXWPK-BFMVXSJESA-N,"InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1",O=C(OC[C@H]1O[C@@H](Oc2ccccc2CO)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1,C20H22O8,,390.13146766399984,HHSKNLJWHGXWPK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Scolopia chinensis,5763668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Scolopieae'],['Scolopia'],['Scolopia chinensis'],4,3,7.596085548400879 6839,2098,1135,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.5240214,ISDB,HHSKNLJWHGXWPK-BFMVXSJESA-N,"InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1",O=C(OC[C@H]1O[C@@H](Oc2ccccc2CO)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1,C20H22O8,,390.13146766399984,HHSKNLJWHGXWPK,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Itoa orientalis,967598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Flacourtieae'],['Itoa'],['Itoa orientalis'],4,3,7.596085548400879 6840,2095,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.45412284,ISDB,OVWDRYCZWVUZQT-OMAYRMBQSA-N,"InChI=1S/C24H40O11/c1-12-7-14(8-23(3,4)15(12)6-5-13(2)26)34-21-19(29)18(28)17(27)16(35-21)9-32-22-20(30)24(31,10-25)11-33-22/h14,16-22,25,27-31H,5-11H2,1-4H3/t14-,16+,17+,18-,19+,20+,21+,22-,24-/m0/s1",CC(=O)CCC1=C(C)C[C@H](O[C@@H]2O[C@H](CO[C@H]3OC[C@@](O)(CO)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C24H40O11,,504.2570621,OVWDRYCZWVUZQT,Terpenoids,Apocarotenoids,Megastigmanes,Sargentodoxa cuneata,639710.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Lardizabalaceae'],['Unknown'],['Sargentodoxa'],['Sargentodoxa cuneata'],4,1,6.316491365432739 6841,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Oldenlandia herbacea var. herbacea,1062412.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Oldenlandia'],['Oldenlandia herbacea'],4,3,7.285305738449097 6842,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-UHFFFAOYSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(C)=O)=CC(O)C12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Oldenlandia diffusa,161897.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Oldenlandia'],['Oldenlandia diffusa'],4,3,7.285305738449097 6843,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Spermacoce verticillata,606235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Hedyotis'],['Hedyotis verticillata'],4,3,7.285305738449097 6844,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Daphniphyllum himalense,5729568.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Daphniphyllaceae'],['Unknown'],['Daphniphyllum'],['Daphniphyllum himalense'],4,3,7.285305738449097 6845,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Daphniphyllum angustifolium,7050033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Daphniphyllaceae'],['Unknown'],['Daphniphyllum'],['Daphniphyllum angustifolium'],4,3,7.285305738449097 6846,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Daphniphyllum himalayense,559409.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Daphniphyllaceae'],['Unknown'],['Daphniphyllum'],['Daphniphyllum himalaense'],4,3,7.285305738449097 6847,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-XYRJWDFLSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11-,12-,13+,14-,15+,16-,18+,19+/m1/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@@H](O)[C@H]12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Daphniphyllum macropodum,828634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Daphniphyllaceae'],['Unknown'],['Daphniphyllum'],['Daphniphyllum macropodum'],4,3,7.285305738449097 6848,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Spermacoce latifolia,7053645.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Spermacoce'],['Spermacoce latifolia'],4,3,7.285305738449097 6849,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Spermacoce alata,3871861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Spermacoce'],['Spermacoce alata'],4,3,7.285305738449097 6850,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-UHFFFAOYSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(C)=O)=CC(O)C12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Mycaranthes latifolia,3992452.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Eria'],['Eria iridifolia'],4,3,7.285305738449097 6851,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Paederia foetida,716211.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Paederieae'],['Paederia'],['Paederia foetida'],4,3,7.285305738449097 6852,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Paederia scandens,611353.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Paederieae'],['Paederia'],['Paederia scandens'],4,3,7.285305738449097 6853,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-UHFFFAOYSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(C)=O)=CC(O)C12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Paederia,716213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Paederieae'],['Paederia'],['Unknown'],4,3,7.285305738449097 6854,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-UHFFFAOYSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(C)=O)=CC(O)C12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium verum,541023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium verum'],4,3,7.285305738449097 6855,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Oldenlandia hedyotidea,84591.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Spermacoceae'],['Oldenlandia'],['Oldenlandia hedyotidea'],4,3,7.285305738449097 6856,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-UHFFFAOYSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(C)=O)=CC(O)C12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lasianthus,447902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Lasiantheae'],['Lasianthus'],['Unknown'],4,3,7.285305738449097 6857,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Escallonia myrtoidea,532769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Escalloniales'],['Escalloniaceae'],['Unknown'],['Escallonia'],['Escallonia myrtoidea'],4,3,7.285305738449097 6858,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium lovcense,3873065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium lovcense'],4,3,7.285305738449097 6859,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium humifusum,7053600.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium humifusum'],4,3,7.285305738449097 6860,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium rhodopeum,3872802.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium rhodopeum'],4,3,7.285305738449097 6861,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Crucianella graeca,3872711.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Crucianella'],['Crucianella graeca'],4,3,7.285305738449097 6862,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Cruciata laevipes,442651.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Cruciata'],['Cruciata laevipes'],4,3,7.285305738449097 6863,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Cruciata pedemontana,221977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Cruciata'],['Cruciata pedemontana'],4,3,7.285305738449097 6864,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium aegeum,3873173.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium aegeum'],4,3,7.285305738449097 6865,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium album,807617.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium album'],4,3,7.285305738449097 6866,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium macedonicum,3872925.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium macedonicum'],4,3,7.285305738449097 6867,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Globularia bisnagarica,7053916.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Globularieae'],['Globularia'],['Globularia bisnagarica'],4,3,7.285305738449097 6868,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium mirum,3873051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium mirum'],4,3,7.285305738449097 6869,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-UHFFFAOYSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(C)=O)=CC(O)C12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Globularia vulgaris,5783296.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Globularieae'],['Globularia'],['Globularia vulgaris'],4,3,7.285305738449097 6870,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lamium amplexicaule,907329.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Lamieae'],['Lamium'],['Lamium amplexicaule'],4,3,7.285305738449097 6871,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-HOZAMIDDSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12+,13-,14+,15-,16+,18-,19-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(C)=O)=C[C@H](O)[C@H]12,C19H26O12,,446.1424262719998,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Galium mollugo,720440.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Rubieae'],['Galium'],['Galium mollugo'],4,3,7.285305738449097 6872,2094,1509,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44632643,ISDB,YSOBQIMODQOGKQ-UHFFFAOYSA-N,"InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(COC(C)=O)=CC(O)C12,C19H26O12,,446.142426272,YSOBQIMODQOGKQ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Globularia punctata,150364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Plantaginaceae'],['Globularieae'],['Globularia'],['Globularia punctata'],4,3,7.285305738449097 6873,2089,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.0,MS1_match,SESFRYSPDFLNCH-UHFFFAOYSA-N,"InChI=1S/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2",O=C(OCc1ccccc1)c1ccccc1,C14H12O2,pos_1_1proton1acetonitrile,212.083729624,SESFRYSPDFLNCH,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6874,2083,101,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.6750192,ISDB,FXVRSKPFWVYCPN-UHFFFAOYSA-N,"InChI=1S/C12H8O6/c13-6-2-1-4-8-5(12(17)18-11(4)6)3-7(14)9(15)10(8)16/h3,14-16H,1-2H2",O=C1CCc2c1oc(=O)c1cc(O)c(O)c(O)c21,C12H8O6,,248.032087976,FXVRSKPFWVYCPN,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Punica granatum,646814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Punica'],['Punica granatum'],4,3,8.200076818466187 6875,2083,101,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.6750192,ISDB,FXVRSKPFWVYCPN-UHFFFAOYSA-N,"InChI=1S/C12H8O6/c13-6-2-1-4-8-5(12(17)18-11(4)6)3-7(14)9(15)10(8)16/h3,14-16H,1-2H2",O=C1CCc2c1oc(=O)c1cc(O)c(O)c(O)c21,C12H8O6,,248.032087976,FXVRSKPFWVYCPN,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Canarium album,146994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Burseraceae'],['Unknown'],['Canarium'],['Canarium album'],4,3,8.200076818466187 6876,2083,101,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.6750192,ISDB,FXVRSKPFWVYCPN-UHFFFAOYSA-N,"InChI=1S/C12H8O6/c13-6-2-1-4-8-5(12(17)18-11(4)6)3-7(14)9(15)10(8)16/h3,14-16H,1-2H2",O=C1CCc2c1oc(=O)c1cc(O)c(O)c(O)c21,C12H8O6,,248.032087976,FXVRSKPFWVYCPN,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Euphorbia,109494.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Euphorbieae'],['Euphorbia'],['Unknown'],4,3,8.200076818466187 6877,2080,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.32120255,ISDB,DSEWISSCBVZORR-UHFFFAOYSA-N,"InChI=1S/C11H16O4/c1-8-3-4-9(10(14)5-8)11(6-12,7-13)15-2/h3-5,12-14H,6-7H2,1-2H3",COC(CO)(CO)c1ccc(C)cc1O,C11H16O4,,212.104858992,DSEWISSCBVZORR,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Inula hupehensis,7051735.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Inula'],['Inula hupehensis'],4,1,5.784810185432434 6878,2079,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.8056568,ISDB,REFJWTPEDVJJIY-UHFFFAOYSA-N,"InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H",O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O7,,302.04265266,REFJWTPEDVJJIY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],8,3,12.72262716293335 6879,2078,-1,,,,0.0,MS1_match,NPFVOOAXDOBMCE-PLNGDYQASA-N,"InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4-",CC/C=C\CCOC(C)=O,C8H14O2,pos_1_1proton,142.099379688,NPFVOOAXDOBMCE,Fatty acids,Fatty esters,Wax monoesters,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6880,2076,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.39679524,ISDB,,,,,,,LTBQYBFNCXAVEB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5871809720993042 6881,2075,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_sodium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,3,9.5 6882,2075,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_sodium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,3,9.5 6883,2075,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_sodium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,3,9.5 6884,2074,661,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.33364198,ISDB,KZOPHCFMEGMURT-UHFFFAOYSA-N,"InChI=1S/C16H11NO6/c18-14-7-4-11(9-13(14)17-22)16(21)23-12-5-1-10(2-6-12)3-8-15(19)20/h1-9,18H,(H,19,20)",O=Nc1cc(C(=O)Oc2ccc(C=CC(=O)O)cc2)ccc1O,C16H11NO6,,313.058637072,KZOPHCFMEGMURT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,3,2.834567904472351 6885,2073,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,HPJJCRNQEWRFQW-ILXVDBEPSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(14(22)9-18)27-15(23)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-22,25H,2,8-9H2,1H3/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,HPJJCRNQEWRFQW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6886,2073,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CPYDMLXRLHYXSV-UNKAVFLYSA-N,"InChI=1S/C18H22O9/c1-25-13-7-10(3-5-11(13)19)4-6-15(21)27-14-9-18(24,17(23)26-2)8-12(20)16(14)22/h3-7,12,14,16,19-20,22,24H,8-9H2,1-2H3/b6-4+/t12-,14-,16-,18+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(OC)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,CPYDMLXRLHYXSV,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6887,2073,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6888,2073,60,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1acetonitrile,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 6889,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6890,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6891,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 6892,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,0,7.0 6893,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,0,7.0 6894,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 6895,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 6896,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6897,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 6898,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton1methanol,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,0,7.0 6899,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 6900,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,0,7.0 6901,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6902,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,0,7.0 6903,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton1methanol,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 6904,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton1methanol,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,0,7.0 6905,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton1methanol,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6906,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton1methanol,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 6907,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1methanol,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 6908,2072,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton1methanol,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 6909,2069,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.43153015,ISDB,FLRRQCMZWPQERP-NYODVFMBSA-N,"InChI=1S/C16H20O9/c1-7(4-8-2-3-9(18)10(19)5-8)15(23)25-16-14(22)13(21)12(20)11(6-17)24-16/h2-5,11-14,16-22H,6H2,1H3/b7-4+/t11-,12-,13+,14-,16+/m1/s1",C/C(=C\c1ccc(O)c(O)c1)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H20O9,,356.11073222,FLRRQCMZWPQERP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Camellia reticulata,83755.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia reticulata'],4,3,7.226120591163635 6910,2066,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.72572273,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Sideritis infernalis,218370.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis infernalis'],4,1,7.402890920639038 6911,2066,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.72572273,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Piper philippinum,290828.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper nudibaccatum'],4,1,7.402890920639038 6912,2066,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.72572273,ISDB,VEZIKIAGFYZTCI-YVMONPNESA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3/b8-5-",COC(=O)/C=C\c1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Haplophyllum latifolium,762596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Haplophyllum'],['Haplophyllum latifolium'],4,1,7.402890920639038 6913,2066,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.72572273,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Scrophularia buergeriana,764427.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Scrophularia'],['Scrophularia buergeriana'],4,1,7.402890920639038 6914,2066,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.72572273,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Gmelina asiatica,3883027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Gmelina'],['Gmelina asiatica'],4,1,7.402890920639038 6915,2066,470,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.72572273,ISDB,VEZIKIAGFYZTCI-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3",COC(=O)C=Cc1ccc(OC)cc1,C11H12O3,,192.078644244,VEZIKIAGFYZTCI,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Philotheca obovalis,6126545.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Philotheca'],['Philotheca obovalis'],4,1,7.402890920639038 6916,2065,-1,,,,0.34699324,ISDB,,,,,,,WGPJMKWCIFKCET,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.3879729509353638 6917,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-RMKGEEGASA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19+,20-,22-,23+,24-,27+,28+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.2162599079999,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Sinoadina racemosa,1089075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Sinoadina'],['Sinoadina racemosa'],4,1,5.485155463218689 6918,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-LQDMBTRHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14-,18-,19-,20+,22+,23-,24+,27-,28-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Uncaria tomentosa,204985.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Uncaria'],['Uncaria tomentosa'],4,1,5.485155463218689 6919,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-BZAIPKEHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14-,18-,19+,20-,22-,23+,24-,27+,28+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@@H]1C[C@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Psychotria bahiensis,180165.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Psychotrieae'],['Psychotria'],['Psychotria bahiensis'],4,1,5.485155463218689 6920,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-UHFFFAOYSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1NC(C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Simira tinctoria,658663.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Condamineeae'],['Simira'],['Simira tinctoria'],4,1,5.485155463218689 6921,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-AZAOCEFRSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19+,20+,22+,23-,24+,27+,28-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.2162599079999,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Simira rubescens,389648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Condamineeae'],['Simira'],['Simira rubescens'],4,1,5.485155463218689 6922,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-BUZHDDSHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19-,20+,22+,23-,24+,27+,28-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Chimarrhis turbinata,327026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Condamineeae'],['Chimarrhis'],['Chimarrhis turbinata'],4,1,5.485155463218689 6923,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-AZAOCEFRSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14+,18+,19+,20+,22+,23-,24+,27+,28-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.2162599079999,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Stenostomum acreanum,155313.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Guettardeae'],['Stenostomum'],['Stenostomum acreanum'],4,1,5.485155463218689 6924,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-UHFFFAOYSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1NC(C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Rhazya stricta,618442.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Amsonieae'],['Rhazya'],['Rhazya stricta'],4,1,5.485155463218689 6925,2064,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.24628887,ISDB,LHKZIVMTXZLOTP-BZAIPKEHSA-N,"InChI=1S/C28H34N2O11/c1-3-12-14(8-18-21-15(9-19(29-18)25(35)36)13-6-4-5-7-17(13)30-21)16(26(37)38-2)11-39-27(12)41-28-24(34)23(33)22(32)20(10-31)40-28/h3-7,11-12,14,18-20,22-24,27-34H,1,8-10H2,2H3,(H,35,36)/t12-,14-,18-,19+,20-,22-,23+,24-,27+,28+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@@H]1C[C@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21,C28H34N2O11,,574.216259908,LHKZIVMTXZLOTP,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Amsonia orientalis,15769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Amsonieae'],['Amsonia'],['Amsonia orientalis'],4,1,5.485155463218689 6926,2063,973,Terpenoids,Polyprenols,Labdane diterpenoids,0.20188478,ISDB,,,,,,,ZRNXNRWWCKQFOL,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8075391054153442 6927,2061,-1,,,,0.20111132,ISDB,MLKFESWUFLKYRE-UHFFFAOYSA-N,"InChI=1S/C13H17NO5/c1-19-13(18)10-6-14(4-5-15)12(17)11-8(7-16)2-3-9(10)11/h2,6,9,11,15-16H,3-5,7H2,1H3",COC(=O)C1=CN(CCO)C(=O)C2C(CO)=CCC12,C13H17NO5,,267.110672644,MLKFESWUFLKYRE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Gardenia jasminoides,919367.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Gardenieae'],['Gardenia'],['Gardenia jasminoides'],4,0,4.804445266723633 6928,2057,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.45788208,ISDB,RFYNAVYPYXLVOM-HNNXBMFYSA-N,"InChI=1S/C16H17NO2/c18-12-15(11-13-7-3-1-4-8-13)17-16(19)14-9-5-2-6-10-14/h1-10,15,18H,11-12H2,(H,17,19)/t15-/m0/s1",O=C(N[C@H](CO)Cc1ccccc1)c1ccccc1,C16H17NO2,,255.125928784,RFYNAVYPYXLVOM,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Croton hieronymi,3913472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton hieronymi'],4,1,6.331528306007385 6929,2057,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.45788208,ISDB,RFYNAVYPYXLVOM-HNNXBMFYSA-N,"InChI=1S/C16H17NO2/c18-12-15(11-13-7-3-1-4-8-13)17-16(19)14-9-5-2-6-10-14/h1-10,15,18H,11-12H2,(H,17,19)/t15-/m0/s1",O=C(N[C@H](CO)Cc1ccccc1)c1ccccc1,C16H17NO2,,255.125928784,RFYNAVYPYXLVOM,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Begonia nantoensis,74758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Begoniaceae'],['Unknown'],['Begonia'],['Begonia nantoensis'],4,1,6.331528306007385 6930,2057,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.45788208,ISDB,RFYNAVYPYXLVOM-HNNXBMFYSA-N,"InChI=1S/C16H17NO2/c18-12-15(11-13-7-3-1-4-8-13)17-16(19)14-9-5-2-6-10-14/h1-10,15,18H,11-12H2,(H,17,19)/t15-/m0/s1",O=C(N[C@H](CO)Cc1ccccc1)c1ccccc1,C16H17NO2,,255.125928784,RFYNAVYPYXLVOM,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Houttuynia cordata,972211.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Saururaceae'],['Unknown'],['Houttuynia'],['Houttuynia cordata'],4,1,6.331528306007385 6931,2056,150,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.29606414,ISDB,RMTHFMSBPWQULL-BJLHFBGVSA-N,"InChI=1S/C18H25NO8S/c1-2-8-9-5-12-19(3-4-28-12)16(24)10(9)7-25-17(8)27-18-15(23)14(22)13(21)11(6-20)26-18/h2,7-9,11-15,17-18,20-23H,1,3-6H2/t8-,9+,11-,12+,13-,14+,15-,17+,18+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCS[C@H]3C[C@H]21,C18H25NO8S,,415.13008776,RMTHFMSBPWQULL,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera xylosteum,218830.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera xylosteum'],8,3,10.684256553649902 6932,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-IKCGAKJISA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,24+,27-,28-/m1/s1",COc1cc(-c2oc3cc(O[C@H]4O[C@H](C)[C@@H](O)[C@H](O)[C@@H]4O)cc(O)c3c(=O)c2O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Phedimus selskianus,300990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Crassulaceae'],['Unknown'],['Phedimus'],['Phedimus selskianus'],4,0,4.9528191685676575 6933,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-NUBQEMHQSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9?,16?,18-,19+,21-,22?,23?,24?,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O[C@@H]2OC(CO)[C@@H](O)C(O)C2O)ccc1O,C28H32O16,,624.1690349439999,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,4.9528191685676575 6934,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-NUBQEMHQSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9?,16?,18-,19+,21-,22?,23?,24?,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O[C@@H]2OC(CO)[C@@H](O)C(O)C2O)ccc1O,C28H32O16,,624.1690349439999,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Diplotaxis acris,807843.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Unknown'],['Unknown'],4,0,4.9528191685676575 6935,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-AKTJOMHVSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19-,21-,22-,23-,24+,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@H](O)[C@@H]4O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Chrozophora plicata,3911324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Chrozophoreae'],['Chrozophora'],['Chrozophora plicata'],4,0,4.9528191685676575 6936,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-AKTJOMHVSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19-,21-,22-,23-,24+,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@H](O)[C@@H]4O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Chrozophora obliqua,3911324.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Chrozophoreae'],['Chrozophora'],['Chrozophora plicata'],4,0,4.9528191685676575 6937,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-AKTJOMHVSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19-,21-,22-,23-,24+,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@H](O)[C@@H]4O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Sedum sarmentosum,810620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Crassulaceae'],['Unknown'],['Sedum'],['Sedum sarmentosum'],4,0,4.9528191685676575 6938,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-UHFFFAOYSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3",COc1cc(-c2oc3cc(OC4OC(C)C(O)C(O)C4O)cc(O)c3c(=O)c2OC2OC(CO)C(O)C(O)C2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Coprosma,302903.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Anthospermeae'],['Coprosma'],['Unknown'],4,0,4.9528191685676575 6939,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-YJRPMJBWSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16-,18-,19-,21+,22+,23+,24-,27-,28+/m1/s1",COc1cc(-c2oc3cc(O[C@H]4O[C@H](C)[C@@H](O)[C@H](O)[C@@H]4O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cardiocrinum cordatum,962648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Cardiocrinum'],['Cardiocrinum cordatum'],4,0,4.9528191685676575 6940,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-ZLEZCFKXSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,24+,27+,28+/m0/s1",COc1cc(-c2oc3cc(O[C@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c(=O)c2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Hippophae rhamnoides,623185.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Elaeagnaceae'],['Unknown'],['Unknown'],['Hippophae rhamnoides'],4,0,4.9528191685676575 6941,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-UHFFFAOYSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3",COc1cc(-c2oc3cc(OC4OC(C)C(O)C(O)C4O)cc(O)c3c(=O)c2OC2OC(CO)C(O)C(O)C2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lathyrus chrysanthus,6095915.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Lathyrus'],['Lathyrus chrysanthus'],4,0,4.9528191685676575 6942,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-SZBCTZJWSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16-,18-,19-,21+,22-,23-,24-,27-,28+/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@@H]4O)cc(O)c3c(=O)c2O[C@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)ccc1O,C28H32O16,,624.169034944,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Peumus boldus,913184.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Monimiaceae'],['Unknown'],['Peumus'],['Peumus boldus'],4,0,4.9528191685676575 6943,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-NUBQEMHQSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9?,16?,18-,19+,21-,22?,23?,24?,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O[C@@H]2OC(CO)[C@@H](O)C(O)C2O)ccc1O,C28H32O16,,624.1690349439999,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cleome ovalifolia,652888.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Cleomaceae'],['Unknown'],['Cleome'],['Cleome droserifolia'],4,0,4.9528191685676575 6944,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-NUBQEMHQSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9?,16?,18-,19+,21-,22?,23?,24?,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O[C@@H]2OC(CO)[C@@H](O)C(O)C2O)ccc1O,C28H32O16,,624.1690349439999,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cleome droserifolia,652888.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Cleomaceae'],['Unknown'],['Cleome'],['Cleome droserifolia'],4,0,4.9528191685676575 6945,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-PXBUXKMDSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,24+,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C28H32O16,,624.1690349439999,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Reseda luteola,359604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Resedaceae'],['Unknown'],['Reseda'],['Reseda luteola'],4,0,4.9528191685676575 6946,2055,-1,,,,0.23820479,ISDB,NEJKEXUJCSYMCC-PXBUXKMDSA-N,"InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(40-9)41-11-6-13(31)17-15(7-11)42-25(10-3-4-12(30)14(5-10)39-2)26(20(17)34)44-28-24(38)22(36)19(33)16(8-29)43-28/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,24+,27-,28-/m0/s1",COc1cc(-c2oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C28H32O16,,624.1690349439999,NEJKEXUJCSYMCC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Astragalus laxmannii,3925254.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Astragalus'],['Astragalus laxmannii'],4,0,4.9528191685676575 6947,2054,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.47261217,ISDB,PXMONFDWFWAIMC-MPSLSGHYSA-N,"InChI=1S/C21H36O7/c1-20(2,28-19-18(26)17(25)16(24)15(11-23)27-19)13-6-8-21(3)7-4-5-12(10-22)14(21)9-13/h5,13-19,22-26H,4,6-11H2,1-3H3/t13-,14+,15-,16-,17+,18-,19+,21-/m1/s1",CC(C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H]1CC[C@@]2(C)CCC=C(CO)[C@@H]2C1,C21H36O7,,400.2461034919999,PXMONFDWFWAIMC,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Juglans regia,138717.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Juglans'],['Juglans regia'],4,3,7.390448689460754 6948,2053,101,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.6750192,ISDB,FXVRSKPFWVYCPN-UHFFFAOYSA-N,"InChI=1S/C12H8O6/c13-6-2-1-4-8-5(12(17)18-11(4)6)3-7(14)9(15)10(8)16/h3,14-16H,1-2H2",O=C1CCc2c1oc(=O)c1cc(O)c(O)c(O)c21,C12H8O6,,248.032087976,FXVRSKPFWVYCPN,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Punica granatum,646814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Punica'],['Punica granatum'],4,3,8.200076818466187 6949,2053,101,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.6750192,ISDB,FXVRSKPFWVYCPN-UHFFFAOYSA-N,"InChI=1S/C12H8O6/c13-6-2-1-4-8-5(12(17)18-11(4)6)3-7(14)9(15)10(8)16/h3,14-16H,1-2H2",O=C1CCc2c1oc(=O)c1cc(O)c(O)c(O)c21,C12H8O6,,248.032087976,FXVRSKPFWVYCPN,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Canarium album,146994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Burseraceae'],['Unknown'],['Canarium'],['Canarium album'],4,3,8.200076818466187 6950,2053,101,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.6750192,ISDB,FXVRSKPFWVYCPN-UHFFFAOYSA-N,"InChI=1S/C12H8O6/c13-6-2-1-4-8-5(12(17)18-11(4)6)3-7(14)9(15)10(8)16/h3,14-16H,1-2H2",O=C1CCc2c1oc(=O)c1cc(O)c(O)c(O)c21,C12H8O6,,248.032087976,FXVRSKPFWVYCPN,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Euphorbia,109494.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Euphorbieae'],['Euphorbia'],['Unknown'],4,3,8.200076818466187 6951,2052,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_sodium,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 6952,2052,-1,,,,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_sodium,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,0,8.0 6953,2050,-1,,,,0.0,MS1_match,ZKKNABJGMLHVHS-DIACKHNESA-N,"InChI=1S/C14H18O9/c15-4-9-10(17)11(18)12(19)14(23-9)22-5-6-3-7(16)1-2-8(6)13(20)21/h1-3,9-12,14-19H,4-5H2,(H,20,21)/t9-,10-,11+,12-,14+/m1/s1",O=C(O)c1ccc(O)cc1CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C14H18O9,pos_1_sodium,330.095082156,ZKKNABJGMLHVHS,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 6954,2046,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1ammonium,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 6955,2046,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1ammonium,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 6956,2046,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,VHHJRIJKJTYYIZ-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-10-14(4-3-9-27)5-7-16(18)36-20(12-28)22(30)15-6-8-17(19(11-15)35-2)37-26-25(33)24(32)23(31)21(13-29)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C26H36O12,pos_1_1proton1ammonium,540.220676592,VHHJRIJKJTYYIZ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 6957,2046,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,HZYWTYSKPVTFNA-URGBZLTBSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)30)25(38-26-24(33)23(32)22(31)20(12-28)37-26)21(13-29)36-17-8-5-14(4-3-9-27)10-19(17)35-2/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21+,22-,23+,24-,25+,26+/m1/s1",COc1cc([C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O,C26H36O12,pos_1_1proton1ammonium,540.220676592,HZYWTYSKPVTFNA,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 6958,2045,330,Terpenoids,Monoterpenoids,Pinane monoterpenoids,0.39526227,ISDB,TVGPYTOYKLZBPA-UHFFFAOYSA-N,"InChI=1S/C15H24O2/c1-10(2)7-14(16)17-9-11-5-6-12-8-13(11)15(12,3)4/h5,10,12-13H,6-9H2,1-4H3",CC(C)CC(=O)OCC1=CCC2CC1C2(C)C,C15H24O2,,236.177630008,TVGPYTOYKLZBPA,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,9.081049084663391 6959,2038,1565,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,QBYSXERNIGFSBS-UHFFFAOYSA-N,"InChI=1S/C22H32O14/c1-2-8-9-3-4-31-19(30)10(9)7-32-20(8)36-22-17(29)18(14(26)12(6-24)34-22)35-21-16(28)15(27)13(25)11(5-23)33-21/h2,7-9,11-18,20-29H,1,3-6H2",C=CC1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)OC=C2C(=O)OCCC21,C22H32O14,pos_1_1proton1acetonitrile,520.179205704,QBYSXERNIGFSBS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 6960,2038,1565,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,QBYSXERNIGFSBS-UHFFFAOYSA-N,"InChI=1S/C22H32O14/c1-2-8-9-3-4-31-19(30)10(9)7-32-20(8)36-22-17(29)18(14(26)12(6-24)34-22)35-21-16(28)15(27)13(25)11(5-23)33-21/h2,7-9,11-18,20-29H,1,3-6H2",C=CC1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)OC=C2C(=O)OCCC21,C22H32O14,pos_1_1proton1acetonitrile,520.179205704,QBYSXERNIGFSBS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 6961,2036,170,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ATFJUGCMEQBNLH-UHFFFAOYSA-N,"InChI=1S/C10H14O5/c1-10-6(12)2-4-5(3-11)9(15-10)14-8(13)7(4)10/h4-7,9,11-12H,2-3H2,1H3",CC12OC3OC(=O)C1C(CC2O)C3CO,C10H14O5,pos_1_1sodium1acetonitrile,214.084123548,ATFJUGCMEQBNLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 6962,2034,1196,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,0.0,MS1_match,RKWHWFONKJEUEF-WYFQJXRYSA-N,"InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/t16-,17+,18+,19-,21?/m1/s1",[O-]c1cc(-c2[o+]c3cc(O)cc(O)c3cc2OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O,C21H20O11,pos_1_1proton,448.10056146,RKWHWFONKJEUEF,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 6963,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-FQEVSTJZSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3/t20-/m0/s1",COc1ccc2c(c1OC)[C@H](O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.1263227079999,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Berberis insignis,279901.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis insignis'],4,2,7.828688383102417 6964,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-FQEVSTJZSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3/t20-/m0/s1",COc1ccc2c(c1OC)[C@H](O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.1263227079999,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],4,2,7.828688383102417 6965,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-FQEVSTJZSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3/t20-/m0/s1",COc1ccc2c(c1OC)[C@H](O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.1263227079999,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Coptis japonica,387829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis japonica'],4,2,7.828688383102417 6966,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-FQEVSTJZSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3/t20-/m0/s1",COc1ccc2c(c1OC)[C@H](O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.1263227079999,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Berberis vulgaris,996604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis vulgaris'],4,2,7.828688383102417 6967,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-FQEVSTJZSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3/t20-/m0/s1",COc1ccc2c(c1OC)[C@H](O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.1263227079999,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Toddalia asiatica,232693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Toddalia'],['Toddalia asiatica'],4,2,7.828688383102417 6968,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-UHFFFAOYSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3",COc1ccc2c(c1OC)C(O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.126322708,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Coscinium fenestratum,688896.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Coscinieae'],['Coscinium'],['Coscinium fenestratum'],4,2,7.828688383102417 6969,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-FQEVSTJZSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3/t20-/m0/s1",COc1ccc2c(c1OC)[C@H](O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.1263227079999,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Berberis umbellata,921543.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Berberis'],['Berberis umbellata'],4,2,7.828688383102417 6970,2033,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7071721,ISDB,ZRBGFWOXAQPDTH-FQEVSTJZSA-N,"InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3/t20-/m0/s1",COc1ccc2c(c1OC)[C@H](O)N1CCc3cc4c(cc3C1=C2)OCO4,C20H19NO5,,353.1263227079999,ZRBGFWOXAQPDTH,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Argemone mexicana,408476.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Argemone'],['Argemone mexicana'],4,2,7.828688383102417 6971,2031,170,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.6200715,ISDB,,,,,,,QQQCHSOAVNFEBG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.480285882949829 6972,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 6973,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,2,8.0 6974,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,2,8.0 6975,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 6976,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 6977,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 6978,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6979,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 6980,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,2,8.0 6981,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 6982,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 6983,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 6984,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6985,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 6986,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,2,8.0 6987,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,2,8.0 6988,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 6989,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 6990,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 6991,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6992,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,2,8.0 6993,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,2,8.0 6994,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6995,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,2,8.0 6996,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,2,8.0 6997,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_1_1proton1ammonium,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6998,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 6999,2026,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_1_1proton1ammonium,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,2,8.0 7000,2025,973,Terpenoids,Polyprenols,Labdane diterpenoids,0.40618357,ISDB,ARZVCSLAOOTNER-UHFFFAOYSA-N,"InChI=1S/C38H64O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-20-35(40)41-28-36(4)23-19-24-37(5)32-22-21-31-27-38(32,26-29(31)2)34(25-33(36)37)42-30(3)39/h31-34H,2,6-28H2,1,3-5H3",C=C1CC23CC1CCC2C1(C)CCCC(C)(COC(=O)CCCCCCCCCCCCCCC)C1CC3OC(C)=O,C38H64O4,,584.480460528,ARZVCSLAOOTNER,Terpenoids,Diterpenoids,Labdane diterpenoids,Sideritis lotsyi,218375.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis lotsyi'],4,3,7.124734282493591 7001,2025,973,Terpenoids,Polyprenols,Labdane diterpenoids,0.40618357,ISDB,ARZVCSLAOOTNER-QCBCFOTHSA-N,"InChI=1S/C38H64O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-20-35(40)41-28-36(4)23-19-24-37(5)32-22-21-31-27-38(32,26-29(31)2)34(25-33(36)37)42-30(3)39/h31-34H,2,6-28H2,1,3-5H3/t31-,32+,33-,34+,36-,37+,38+/m1/s1",C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CCC[C@](C)(COC(=O)CCCCCCCCCCCCCCC)[C@H]1C[C@@H]3OC(C)=O,C38H64O4,,584.4804605279999,ARZVCSLAOOTNER,Terpenoids,Diterpenoids,Labdane diterpenoids,Sideritis soluta,290043.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis soluta'],4,3,7.124734282493591 7002,2025,973,Terpenoids,Polyprenols,Labdane diterpenoids,0.40618357,ISDB,ARZVCSLAOOTNER-QCBCFOTHSA-N,"InChI=1S/C38H64O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-20-35(40)41-28-36(4)23-19-24-37(5)32-22-21-31-27-38(32,26-29(31)2)34(25-33(36)37)42-30(3)39/h31-34H,2,6-28H2,1,3-5H3/t31-,32+,33-,34+,36-,37+,38+/m1/s1",C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CCC[C@](C)(COC(=O)CCCCCCCCCCCCCCC)[C@H]1C[C@@H]3OC(C)=O,C38H64O4,,584.4804605279999,ARZVCSLAOOTNER,Terpenoids,Diterpenoids,Labdane diterpenoids,Sideritis ferrensis,218364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis ferrensis'],4,3,7.124734282493591 7003,2025,973,Terpenoids,Polyprenols,Labdane diterpenoids,0.40618357,ISDB,ARZVCSLAOOTNER-QCBCFOTHSA-N,"InChI=1S/C38H64O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-20-35(40)41-28-36(4)23-19-24-37(5)32-22-21-31-27-38(32,26-29(31)2)34(25-33(36)37)42-30(3)39/h31-34H,2,6-28H2,1,3-5H3/t31-,32+,33-,34+,36-,37+,38+/m1/s1",C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CCC[C@](C)(COC(=O)CCCCCCCCCCCCCCC)[C@H]1C[C@@H]3OC(C)=O,C38H64O4,,584.4804605279999,ARZVCSLAOOTNER,Terpenoids,Diterpenoids,Labdane diterpenoids,Sideritis cystosiphon,742029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis cystosiphon'],4,3,7.124734282493591 7004,2023,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.5366455,ISDB,RNAOSOMTAGOVSH-MOYBBJLCSA-N,"InChI=1S/C17H24O9/c1-8-3-11(19)10-4-17(8,24-7-9(10)6-23-2)26-16-15(22)14(21)13(20)12(5-18)25-16/h3,7,10,12-16,18,20-22H,4-6H2,1-2H3/t10-,12-,13-,14+,15-,16+,17+/m1/s1",COCC1=CO[C@]2(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@H]1C(=O)C=C2C,C17H24O9,,372.1420323479999,RNAOSOMTAGOVSH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Paeonia lactiflora,352877.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Paeoniaceae'],['Unknown'],['Paeonia'],['Paeonia lactiflora'],4,3,7.6465818881988525 7005,2022,216,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,WEAUPFXXCUHVAE-MKMMZYOTSA-N,"InChI=1S/C26H28O11/c1-3-11(2)26(34)37-25-22(33)21(32)18(10-27)36-24(25)20-15(30)8-14(29)19-16(31)9-17(35-23(19)20)12-4-6-13(28)7-5-12/h4-9,11,18,21-22,24-25,27-30,32-33H,3,10H2,1-2H3/t11-,18+,21+,22-,24-,25+/m0/s1",CC[C@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12,C26H28O11,pos_2_2sodium,516.163161716,WEAUPFXXCUHVAE,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,2,7.0 7006,2022,216,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,WEAUPFXXCUHVAE-MKMMZYOTSA-N,"InChI=1S/C26H28O11/c1-3-11(2)26(34)37-25-22(33)21(32)18(10-27)36-24(25)20-15(30)8-14(29)19-16(31)9-17(35-23(19)20)12-4-6-13(28)7-5-12/h4-9,11,18,21-22,24-25,27-30,32-33H,3,10H2,1-2H3/t11-,18+,21+,22-,24-,25+/m0/s1",CC[C@H](C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12,C26H28O11,pos_2_2sodium,516.163161716,WEAUPFXXCUHVAE,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,2,7.0 7007,2021,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.5328942,ISDB,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,9.631576776504517 7008,2021,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.5328942,ISDB,BIIOUOJJWZXURZ-ARILJUKYSA-N,"InChI=1S/C15H26O2/c1-10(2)11-5-6-14(3)8-12(16)9-15(4,17)13(14)7-11/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,14+,15-/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)C[C@@](C)(O)[C@@H]2C1,C15H26O2,,238.193280072,BIIOUOJJWZXURZ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,9.631576776504517 7009,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 7010,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,2,7.0 7011,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,2,7.0 7012,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,2,7.0 7013,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 7014,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,2,7.0 7015,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,2,7.0 7016,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,2,7.0 7017,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,2,7.0 7018,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 7019,2019,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,2,7.0 7020,2018,-1,,,,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_2MNa,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 7021,2018,-1,,,,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_2MNa,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 7022,2018,-1,,,,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_2MNa,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,0,8.0 7023,2017,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.48785183,ISDB,YMBIFCWAAQZSSV-SCNAZFEJSA-N,"InChI=1S/C21H38O8/c1-6-21(5,11-7-8-13(2)9-10-15(23)20(3,4)27)29-19-18(26)17(25)16(24)14(12-22)28-19/h6,8,14-19,22-27H,1,7,9-12H2,2-5H3/b13-8+/t14-,15+,16-,17+,18-,19+,21-/m1/s1",C=C[C@](C)(CC/C=C(\C)CC[C@H](O)C(C)(C)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H38O8,,418.256668176,YMBIFCWAAQZSSV,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Epimedium grandiflorum,655264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium grandiflorum'],5,1,7.451407313346863 7024,2016,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.3049952,ISDB,CYEFUTNNSBRMEB-ICCSCHITSA-N,"InChI=1S/C19H22O11/c20-11-3-1-9(5-12(11)21)2-4-14(22)28-8-13-16(24)17(25)18(26)19(30-13)29-10-6-15(23)27-7-10/h1-5,10,13,16-21,24-26H,6-8H2/b4-2+/t10-,13+,16+,17-,18+,19+/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](O[C@@H]2COC(=O)C2)[C@H](O)[C@@H](O)[C@@H]1O,C19H22O11,,426.1162115239999,CYEFUTNNSBRMEB,,,,Sarracenia purpurea,137603.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Sarraceniaceae'],['Unknown'],['Sarracenia'],['Sarracenia purpurea'],4,0,5.219980835914612 7025,2015,-1,,,,0.0,MS1_match,QJVXKWHHAMZTBY-CZZVJJMOSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3-/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C\CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_1proton1ammonium,372.1420323479999,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 7026,2015,-1,,,,0.0,MS1_match,QJVXKWHHAMZTBY-CZZVJJMOSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3-/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C\CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_1proton1ammonium,372.1420323479999,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 7027,2015,-1,,,,0.0,MS1_match,VELYAQRXBJLJAK-XKKWFBPMSA-N,"InChI=1S/C15H24O9/c1-15(21)4-7(17)6-2-3-22-13(9(6)15)24-14-12(20)11(19)10(18)8(5-16)23-14/h2-3,6-14,16-21H,4-5H2,1H3/t6-,7+,8+,9+,10+,11-,12+,13-,14-,15-/m0/s1",C[C@]1(O)C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C15H24O9,pos_1_1proton1acetonitrile,348.142032348,VELYAQRXBJLJAK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,0,6.0 7028,2015,-1,,,,0.0,MS1_match,VELYAQRXBJLJAK-XKKWFBPMSA-N,"InChI=1S/C15H24O9/c1-15(21)4-7(17)6-2-3-22-13(9(6)15)24-14-12(20)11(19)10(18)8(5-16)23-14/h2-3,6-14,16-21H,4-5H2,1H3/t6-,7+,8+,9+,10+,11-,12+,13-,14-,15-/m0/s1",C[C@]1(O)C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C15H24O9,pos_1_1proton1acetonitrile,348.142032348,VELYAQRXBJLJAK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Monteverdia laevis,6092971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia laevis'],6,0,6.0 7029,2013,1217,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.63523984,ISDB,MDZGQAYJCGFSNC-FKBIRUNOSA-N,"InChI=1S/C21H28O11/c1-18-8-30-17(28)19(18,2)16(27)20-5-11(23)32-21(18,20)4-3-9(20)7-29-15-14(26)13(25)12(24)10(6-22)31-15/h3,10,12-16,22,24-27H,4-8H2,1-2H3/t10-,12-,13+,14-,15-,16-,18-,19+,20+,21+/m1/s1",C[C@@]12COC(=O)[C@]1(C)[C@@H](O)[C@@]13CC(=O)O[C@@]21CC=C3CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H28O11,,456.1631617159999,MDZGQAYJCGFSNC,Terpenoids,,,Illicium majus,318167.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Austrobaileyales'],['Schisandraceae'],['Unknown'],['Illicium'],['Illicium majus'],4,1,7.040959358215332 7030,2012,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1proton1ammonium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 7031,2012,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_1_1proton1ammonium,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 7032,2010,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_2MHNH3,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 7033,2010,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_2MHNH3,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7034,2010,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_2MHNH3,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7035,2010,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_2MHNH3,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 7036,2008,170,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.63257724,ISDB,,,,,,,QOIGAYNTLXGYBM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.530308961868286 7037,2007,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.46914464,ISDB,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,2,8.876578569412231 7038,2007,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.46914464,ISDB,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.876578569412231 7039,2007,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.46914464,ISDB,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,8.876578569412231 7040,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_2MHNH3,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 7041,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,2,8.0 7042,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,2,8.0 7043,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,2,8.0 7044,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_2MHNH3,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7045,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,2,8.0 7046,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,2,8.0 7047,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,2,8.0 7048,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-RJFLBQOQSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3/t7-,8+,10-,11+,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)O[C@H](OC)C[C@H]21,C17H24O10,pos_2MHNH3,388.1369469679999,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7049,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 7050,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7051,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7052,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 7053,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 7054,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,2,8.0 7055,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,2,8.0 7056,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 7057,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-FUJZYWHJSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16-,17+/m1/s1",C=C[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7058,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 7059,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 7060,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 7061,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,2,8.0 7062,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-NRZPKYKESA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.1369469679999,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,2,8.0 7063,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CSKKDSFETGLMSB-QOMIBOLPSA-N,"InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC=O,C17H24O10,pos_2MHNH3,388.136946968,CSKKDSFETGLMSB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 7064,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHCH3CN,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7065,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,RAYZRCGMIDUTKS-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-3-7-8-4-11(23-2)26-15(22)9(8)6-24-16(7)27-17-14(21)13(20)12(19)10(5-18)25-17/h3,6-8,10-14,16-21H,1,4-5H2,2H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC(OC)CC21,C17H24O10,pos_2MHNH3,388.136946968,RAYZRCGMIDUTKS,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7066,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHCH3CN,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 7067,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHCH3CN,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 7068,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHCH3CN,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.0 7069,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_2MHNH3,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 7070,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,pos_2MHNH3,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,2,8.0 7071,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,pos_2MHNH3,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 7072,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHCH3CN,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,2,8.0 7073,2006,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,pos_2MHCH3CN,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7074,2005,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7075,2005,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7076,2005,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7077,2005,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7078,2005,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7079,2005,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7080,2004,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_2MHNH3,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7081,2004,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_2MHNH3,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7082,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 7083,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana amurensis,245959.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana amurensis'],6,2,7.0 7084,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 7085,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 7086,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana ficariifolia,5746450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana ficariifolia'],6,2,7.0 7087,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 7088,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 7089,2003,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,MBNGWHIJMBWFHU-UHFFFAOYSA-N,"InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3",COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O,C16H12O6,pos_1_1proton,300.063388104,MBNGWHIJMBWFHU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,2,7.0 7090,2002,-1,,,,0.37717223,ISDB,BNJOMEMREVKHBU-UHFFFAOYSA-N,"InChI=1S/C11H10O4/c1-13-9-6-11-10(14-7-15-11)5-8(9)3-2-4-12/h2-6H,7H2,1H3",COc1cc2c(cc1C=CC=O)OCO2,C11H10O4,,206.0579088,BNJOMEMREVKHBU,Shikimates and Phenylpropanoids,,,Esenbeckia almawillia,6126252.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Esenbeckia'],['Esenbeckia almawillia'],4,0,5.508688926696777 7091,2000,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,VEPJYMZVLHBTJT-ONOSFVFSSA-N,"InChI=1S/C11H14O2/c1-7-3-2-4-8-9(12)5-6-10(13)11(7)8/h4-7,10-11,13H,2-3H2,1H3/t7-,10-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)C=C[C@@H](O)[C@H]21,C11H14O2,pos_1_1proton1acetonitrile,178.099379688,VEPJYMZVLHBTJT,Terpenoids,,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 7092,1993,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_2MH,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7093,1993,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_2MH,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7094,1991,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.54432476,ISDB,LLBXZZOFEUAEOM-UHFFFAOYSA-N,"InChI=1S/C11H14O4/c1-7(2)15-11(13)8-4-5-9(12)10(6-8)14-3/h4-7,12H,1-3H3",COc1cc(C(=O)OC(C)C)ccc1O,C11H14O4,,210.089208928,LLBXZZOFEUAEOM,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,Calycanthus chinensis,913239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Calycanthaceae'],['Unknown'],['Calycanthus'],['Calycanthus chinensis'],4,1,6.6772990226745605 7095,1990,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7096,1990,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1acetonitrile,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7097,1987,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.8585423,ISDB,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,12.934169292449951 7098,1986,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_sodium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 7099,1986,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_sodium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7100,1986,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_sodium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7101,1986,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_sodium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,9.5 7102,1984,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.8319273,ISDB,OIIJXQMSEYQDDI-UHFFFAOYSA-N,"InChI=1S/C13H18/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h7-8,10H,4-6H2,1-3H3",Cc1ccc(C)c2c1CCCC2C,C13H18,,174.140850576,OIIJXQMSEYQDDI,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.827709197998047 7103,1983,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GZSOSUNBTXMUFQ-UHFFFAOYSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3",COc1ccc(-c2cc(=O)c3c(O)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3o2)cc1O,C28H32O15,pos_1_1proton,608.174120324,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 7104,1983,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GZSOSUNBTXMUFQ-CYZBKYQRSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C28H32O15,pos_1_1proton,608.1741203239999,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia caucasica,994163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia caucasica'],6,2,7.0 7105,1983,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GZSOSUNBTXMUFQ-UHFFFAOYSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3",COc1ccc(-c2cc(=O)c3c(O)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3o2)cc1O,C28H32O15,pos_1_1proton,608.174120324,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 7106,1983,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GZSOSUNBTXMUFQ-CYZBKYQRSA-N,"InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C28H32O15,pos_1_1proton,608.1741203239999,GZSOSUNBTXMUFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia caucasica,994163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia caucasica'],6,2,7.0 7107,1980,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7108,1980,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,8.0 7109,1980,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,8.0 7110,1980,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7111,1980,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KMOUJOKENFFTPU-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2",O=c1cc(-c2ccc(O)cc2)oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7112,1980,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KMOUJOKENFFTPU-QNDFHXLGSA-N,"InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C21H20O10,pos_1_1proton,432.1056468399998,KMOUJOKENFFTPU,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,8.0 7113,1979,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1methanol,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 7114,1979,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,BGWXCNUGXLABMC-UHFFFAOYSA-N,"InChI=1S/C10H12O4/c1-4-5-3-6(11)10(2)7(5)8(12)13-9(4)14-10/h5-7,9,11H,1,3H2,2H3",C=C1C2OC(=O)C3C1CC(O)C3(C)O2,C10H12O4,pos_1_1proton,196.073558864,BGWXCNUGXLABMC,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 7115,1976,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_1proton1ammonium,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7116,1976,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,pos_1_1proton1ammonium,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,9.0 7117,1974,963,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.40541327,ISDB,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,3,11.121653079986572 7118,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7119,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7120,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7121,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 7122,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 7123,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 7124,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 7125,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 7126,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 7127,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 7128,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 7129,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7130,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 7131,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 7132,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7133,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7134,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7135,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7136,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton1ammonium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 7137,1973,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton1ammonium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 7138,1972,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_1proton1ammonium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,2,9.0 7139,1972,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_1proton1ammonium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,2,9.0 7140,1972,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,YTZSBJLNMIQROD-RZYLQQLPSA-N,"InChI=1S/C17H26O11/c1-6-11-7(3-10(19)26-6)8(15(23)24-2)5-25-16(11)28-17-14(22)13(21)12(20)9(4-18)27-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6?,7-,9?,10?,11-,12?,13?,14?,16?,17?/m1/s1",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)[C@@H]2C(C)OC(O)C[C@H]12,C17H26O11,pos_1_1proton1ammonium,406.147511652,YTZSBJLNMIQROD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera alpigena,920868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera alpigena'],8,2,9.0 7141,1971,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.45928362,ISDB,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],8,3,11.33713448047638 7142,1970,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RPMNUQRUHXIGHK-UHFFFAOYSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O14,pos_1_1proton,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,2,8.0 7143,1970,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RPMNUQRUHXIGHK-PYXJVEIZSA-N,"InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O14,pos_1_1proton,578.16355564,RPMNUQRUHXIGHK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7144,1965,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_2_2proton,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 7145,1965,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,pos_2_2proton,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,0,7.0 7146,1964,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_2MHNH3,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7147,1964,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_2MHNH3,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7148,1964,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_2MHNH3,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7149,1963,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.21508002,ISDB,RGTONEMDTVVDMY-GRTPNEQMSA-N,"InChI=1S/C16H22O11/c1-2-6-7(3-10(18)19)8(14(23)24)5-25-15(6)27-16-13(22)12(21)11(20)9(4-17)26-16/h2,5-7,9,11-13,15-17,20-22H,1,3-4H2,(H,18,19)(H,23,24)/t6-,7+,9-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O)[C@H]1CC(=O)O,C16H22O11,,390.1162115239998,RGTONEMDTVVDMY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,2,8.860320091247559 7150,1963,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.21508002,ISDB,RGTONEMDTVVDMY-CVJRUUBTSA-N,"InChI=1S/C16H22O11/c1-2-6-7(3-10(18)19)8(14(23)24)5-25-15(6)27-16-13(22)12(21)11(20)9(4-17)26-16/h2,5-7,9,11-13,15-17,20-22H,1,3-4H2,(H,18,19)(H,23,24)/t6-,7+,9+,11+,12-,13+,15+,16-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)O)[C@H]1CC(=O)O,C16H22O11,,390.1162115239998,RGTONEMDTVVDMY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.860320091247559 7151,1963,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.21508002,ISDB,RGTONEMDTVVDMY-UHFFFAOYSA-N,"InChI=1S/C16H22O11/c1-2-6-7(3-10(18)19)8(14(23)24)5-25-15(6)27-16-13(22)12(21)11(20)9(4-17)26-16/h2,5-7,9,11-13,15-17,20-22H,1,3-4H2,(H,18,19)(H,23,24)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC(=O)O,C16H22O11,,390.116211524,RGTONEMDTVVDMY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,2,8.860320091247559 7152,1962,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.26232672,ISDB,PUEUIRDVQIKCCG-UHFFFAOYSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC=O,C16H22O10,,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],8,2,10.049306869506836 7153,1960,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.56997544,ISDB,UVIHEQDHSJMULB-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)25-2)9(15(23)24)6-26-16(7)28-17-14(22)13(21)12(20)10(5-18)27-17/h3,6-8,10,12-14,16-18,20-22H,1,4-5H2,2H3,(H,23,24)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O)[C@H]1CC(=O)OC,C17H24O11,,404.1318615879998,UVIHEQDHSJMULB,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,10.77990174293518 7154,1959,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,ILEDWLMCKZNDJK-UHFFFAOYSA-N,"InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H",O=c1ccc2cc(O)c(O)cc2o1,C9H6O4,pos_1_1proton1methanol,178.026608672,ILEDWLMCKZNDJK,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7155,1958,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,AWNLUIGMHSSXHB-BYPYZUCNSA-N,"InChI=1S/C5H6O3/c6-3-4-1-2-5(7)8-4/h1-2,4,6H,3H2/t4-/m0/s1",O=C1C=C[C@@H](CO)O1,C5H6O3,pos_2MH,114.031694052,AWNLUIGMHSSXHB,,,,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 7156,1957,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton1methanol,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7157,1956,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ammonium,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7158,1956,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ammonium,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7159,1956,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,MQLSOVRLZHTATK-PEYNGXJCSA-N,"InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6-8,10,12-14,16-18,21-23H,1,4-5H2,2H3,(H,19,20)/t7-,8+,10-,12-,13+,14-,16+,17+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O,C17H24O11,pos_1_1proton1ammonium,404.1318615879998,MQLSOVRLZHTATK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],8,3,9.5 7160,1955,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.7067327,ISDB,PTWPWUVEQZXOFJ-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-6-3-1-2-5-4-11-8(10)7(5)6/h1-3,9H,4H2",O=C1OCc2cccc(O)c21,C8H6O3,,150.031694052,PTWPWUVEQZXOFJ,Polyketides,Cyclic polyketides,Phthalide derivatives,Cladosporium,984626.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Capnodiales'],['Cladosporiaceae'],['Unknown'],['Cladosporium'],['Unknown'],1,3,5.32693076133728 7161,1955,179,Polyketides,Cyclic polyketides,Phthalide derivatives,0.7067327,ISDB,PTWPWUVEQZXOFJ-UHFFFAOYSA-N,"InChI=1S/C8H6O3/c9-6-3-1-2-5-4-11-8(10)7(5)6/h1-3,9H,4H2",O=C1OCc2cccc(O)c21,C8H6O3,,150.031694052,PTWPWUVEQZXOFJ,Polyketides,Cyclic polyketides,Phthalide derivatives,Calvolia,186102.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Arachnida'],['Sarcoptiformes'],['Winterschmidtiidae'],['Unknown'],['Calvolia'],['Unknown'],1,3,5.32693076133728 7162,1954,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.23539075,ISDB,MQFAJBBHEYTHKF-BIIVOSGPSA-N,"InChI=1S/C11H14O6/c1-6-8(4-12)7(3-10(13)14)9(5-17-6)11(15)16-2/h4-8H,3H2,1-2H3,(H,13,14)/t6-,7-,8+/m0/s1",COC(=O)C1=CO[C@@H](C)[C@@H](C=O)[C@@H]1CC(=O)O,C11H14O6,,242.079038168,MQFAJBBHEYTHKF,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Olea europaea,23729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Oleeae'],['Olea'],['Olea europaea'],4,3,6.441563010215759 7163,1953,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-UHFFFAOYSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)",O=C(O)C=Cc1ccc(O)c(O)c1,C9H8O4,pos_1_1proton1methanol,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7164,1953,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton1methanol,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 7165,1952,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DNZCAZQBJHUVDX-UNVNEXTGSA-N,"InChI=1S/C35H52O20/c1-6-14-15(8-22(46-3)47-4)17(11-49-32(14)54-34-28(42)26(40)24(38)20(9-36)52-34)31(45)51-19-7-16-18(30(44)48-5)12-50-33(23(16)13(19)2)55-35-29(43)27(41)25(39)21(10-37)53-35/h6,11-16,19-29,32-43H,1,7-10H2,2-5H3/t13-,14+,15-,16+,19-,20+,21+,23+,24+,25+,26-,27-,28+,29+,32-,33-,34-,35-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)[C@H]1CC(OC)OC,C35H52O20,pos_2_1proton1sodium,792.305194064,DNZCAZQBJHUVDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Triplostegia glandulifera,819330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Triplostegia'],['Triplostegia glandulifera'],6,3,7.5 7166,1952,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DNZCAZQBJHUVDX-UNVNEXTGSA-N,"InChI=1S/C35H52O20/c1-6-14-15(8-22(46-3)47-4)17(11-49-32(14)54-34-28(42)26(40)24(38)20(9-36)52-34)31(45)51-19-7-16-18(30(44)48-5)12-50-33(23(16)13(19)2)55-35-29(43)27(41)25(39)21(10-37)53-35/h6,11-16,19-29,32-43H,1,7-10H2,2-5H3/t13-,14+,15-,16+,19-,20+,21+,23+,24+,25+,26-,27-,28+,29+,32-,33-,34-,35-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)[C@H]1CC(OC)OC,C35H52O20,pos_2_1proton1sodium,792.305194064,DNZCAZQBJHUVDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Triplostegia grandiflora,487561.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Triplostegia'],['Triplostegia grandiflora'],6,3,7.5 7167,1952,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DNZCAZQBJHUVDX-LAJPPLAUSA-N,"InChI=1S/C35H52O20/c1-6-14-15(8-22(46-3)47-4)17(11-49-32(14)54-34-28(42)26(40)24(38)20(9-36)52-34)31(45)51-19-7-16-18(30(44)48-5)12-50-33(23(16)13(19)2)55-35-29(43)27(41)25(39)21(10-37)53-35/h6,11-16,19-29,32-43H,1,7-10H2,2-5H3/t13-,14-,15-,16+,19+,20-,21-,23+,24+,25+,26+,27+,28-,29-,32+,33+,34+,35+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3[C@@H]2C)[C@@H]1CC(OC)OC,C35H52O20,pos_2_1proton1sodium,792.305194064,DNZCAZQBJHUVDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 7168,1952,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DNZCAZQBJHUVDX-LAJPPLAUSA-N,"InChI=1S/C35H52O20/c1-6-14-15(8-22(46-3)47-4)17(11-49-32(14)54-34-28(42)26(40)24(38)20(9-36)52-34)31(45)51-19-7-16-18(30(44)48-5)12-50-33(23(16)13(19)2)55-35-29(43)27(41)25(39)21(10-37)53-35/h6,11-16,19-29,32-43H,1,7-10H2,2-5H3/t13-,14-,15-,16+,19+,20-,21-,23+,24+,25+,26+,27+,28-,29-,32+,33+,34+,35+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3[C@@H]2C)[C@@H]1CC(OC)OC,C35H52O20,pos_2_1proton1sodium,792.305194064,DNZCAZQBJHUVDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 7169,1952,265,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DNZCAZQBJHUVDX-UNVNEXTGSA-N,"InChI=1S/C35H52O20/c1-6-14-15(8-22(46-3)47-4)17(11-49-32(14)54-34-28(42)26(40)24(38)20(9-36)52-34)31(45)51-19-7-16-18(30(44)48-5)12-50-33(23(16)13(19)2)55-35-29(43)27(41)25(39)21(10-37)53-35/h6,11-16,19-29,32-43H,1,7-10H2,2-5H3/t13-,14+,15-,16+,19-,20+,21+,23+,24+,25+,26-,27-,28+,29+,32-,33-,34-,35-/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@H]2C)[C@H]1CC(OC)OC,C35H52O20,pos_2_1proton1sodium,792.305194064,DNZCAZQBJHUVDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Pterocephalus pinardii,5144236.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus pinardii'],6,3,7.5 7170,1951,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.32819733,ISDB,XWOHZIIPBYAMJX-KHBMLBSESA-N,"InChI=1S/C11H16O5/c1-5-8(12)3-6-7(10(13)15-2)4-16-11(14)9(5)6/h4-6,8-9,11-12,14H,3H2,1-2H3/t5-,6+,8-,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C11H16O5,,228.099773612,XWOHZIIPBYAMJX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,3,8.81278932094574 7171,1949,49,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.23464076,ISDB,LCQFABCIADLOHG-VOTSOKGWSA-N,"InChI=1S/C14H17NO5/c1-4-5-6-7-8-10(16)11(17)9-12(20-8)14(2,19-3)15-13(9)18/h6-7,16H,4-5H2,1-3H3,(H,15,18)/b7-6+",CCC/C=C/c1oc2c(c(=O)c1O)C(=O)NC2(C)OC,C14H17NO5,,279.110672644,LCQFABCIADLOHG,Amino acids and Peptides,,,Aspergillus terreus,104248.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus terreus'],1,0,1.938563048839569 7172,1947,152,Fatty acids,Fatty Acids and Conjugates,Eremophilane sesquiterpenoids,0.77097756,ISDB,RVEKLXYYCHAMDF-AOSYACOCSA-N,"InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h4-5,7-8H,2-3,6,9-15H2,1H3,(H,17,18)/b5-4+,8-7+",CCC/C=C/C/C=C/CCCCCCCC(=O)O,C16H28O2,,252.208930136,RVEKLXYYCHAMDF,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Asclepias syriaca,148395.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Asclepias'],['Asclepias syriaca'],4,2,8.0839102268219 7173,1945,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.26719972,ISDB,,,,,,,WKZDKIOOVRHFNX,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0687988996505737 7174,1943,223,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-NODAHLOSSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23?/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7175,1943,223,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-NODAHLOSSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23?/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7176,1942,-1,,,,0.55708253,ISDB,HILAULICMJUOLK-UHFFFAOYSA-N,"InChI=1S/C11H16/c1-4-10-6-9(3)7-11(5-2)8-10/h6-8H,4-5H2,1-3H3",CCc1cc(C)cc(CC)c1,C11H16,,148.125200512,HILAULICMJUOLK,,,,Perilla frutescens,295678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Elsholtzieae'],['Perilla'],['Perilla frutescens'],4,0,6.228330135345459 7177,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,YEUIANWBIIZWTM-KORLLVGLSA-N,"InChI=1S/C30H46O4/c1-16(2)17-9-10-20-28(6)14-19(32)24-25(29(28,7)15-23(34)30(17,20)8)18(31)13-21-26(3,4)22(33)11-12-27(21,24)5/h16-17,20-23,33-34H,9-15H2,1-8H3/t17-,20+,21+,22-,23-,27+,28+,29-,30-/m1/s1",CC(C)[C@H]1CC[C@@H]2[C@]1(C)[C@H](O)C[C@]1(C)C3=C(C(=O)C[C@@]21C)[C@@]1(C)CC[C@@H](O)C(C)(C)[C@@H]1CC3=O,C30H46O4,pos_2_1proton1sodium,470.339609952,YEUIANWBIIZWTM,Terpenoids,Triterpenoids,Fernane and Arborinane triterpenoids,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,1,7.5 7178,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_2_1proton1sodium,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla dahurica,972663.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla dahurica'],7,1,7.5 7179,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_2_1proton1sodium,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,1,7.5 7180,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,WCXZTKJFWJFMJG-UHFFFAOYSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)",CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(CO)C5CCC43C)C2C1,C30H46O4,pos_2_1proton1sodium,470.339609952,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,1,7.5 7181,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_2_1proton1sodium,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla dahurica,972663.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla dahurica'],7,1,7.5 7182,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,WCXZTKJFWJFMJG-AOIBKUJJSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,26-,27-,28+,29+,30-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C30H46O4,pos_2_1proton1sodium,470.33960995199993,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,1,7.5 7183,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,FRBHXYYJMYBCSK-SECHYRITSA-N,"InChI=1S/C30H46O4/c1-18(2)19-9-14-30(25(33)34)16-15-28(5)20(24(19)30)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h19-22,24,31H,1,7-17H2,2-6H3,(H,33,34)/t19-,20+,21+,22+,24+,26-,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O4,pos_2_1proton1sodium,470.33960995199993,FRBHXYYJMYBCSK,Terpenoids,Triterpenoids,Lupane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,1,7.5 7184,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,FRBHXYYJMYBCSK-SECHYRITSA-N,"InChI=1S/C30H46O4/c1-18(2)19-9-14-30(25(33)34)16-15-28(5)20(24(19)30)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h19-22,24,31H,1,7-17H2,2-6H3,(H,33,34)/t19-,20+,21+,22+,24+,26-,27-,28+,29+,30-/m0/s1",C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]12,C30H46O4,pos_2_1proton1sodium,470.33960995199993,FRBHXYYJMYBCSK,Terpenoids,Triterpenoids,Lupane triterpenoids,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,1,7.5 7185,1941,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.0,MS1_match,WCXZTKJFWJFMJG-UHFFFAOYSA-N,"InChI=1S/C30H46O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-22,31H,8-18H2,1-6H3,(H,33,34)",CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(CO)C5CCC43C)C2C1,C30H46O4,pos_2_1proton1sodium,470.339609952,WCXZTKJFWJFMJG,Terpenoids,Triterpenoids,Oleanane triterpenoids,Pulsatilla chinensis,34150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla chinensis'],7,1,7.5 7186,1936,506,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.4595333,ISDB,NWDBBLFNNILKKJ-MXMFLMJRSA-N,"InChI=1S/C11H18O3/c1-5-11(3,13)8-6-7-9(2)10(12)14-4/h5,7,13H,1,6,8H2,2-4H3/b9-7+/t11-/m1/s1",C=C[C@@](C)(O)CC/C=C(\C)C(=O)OC,C11H18O3,,198.125594436,NWDBBLFNNILKKJ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Piper aduncum,110421.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper aduncum'],4,2,6.838133215904236 7187,1934,69,Terpenoids,Sesquiterpenoids,Furans,0.45444843,ISDB,GMTBKCJRMNJNFL-UHFFFAOYSA-N,"InChI=1S/C17H26O2/c1-11(10-19-14(4)18)9-15-7-5-12(2)16-8-6-13(3)17(15)16/h9,12,15-16H,5-8,10H2,1-4H3",CC(=O)OCC(C)=CC1CCC(C)C2CCC(C)=C12,C17H26O2,,262.193280072,GMTBKCJRMNJNFL,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.817793726921082 7188,1933,-1,,,,0.0,MS1_match,VNDMFSADMLFAMF-UHFFFAOYSA-N,"InChI=1S/C22H29NO6/c1-10-6-21(19(28)29-4)13-5-12(10)15(25)14(21)17-22(13)8-11(24)7-20(2,9-23(17)3)16(22)18(26)27/h11-14,16-17,24H,1,5-9H2,2-4H3,(H,26,27)",C=C1CC2(C(=O)OC)C3C(=O)C1CC2C12CC(O)CC(C)(CN(C)C31)C2C(=O)O,C22H29NO6,pos_1_1proton1ammonium,403.199487648,VNDMFSADMLFAMF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 7189,1932,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_2_2proton2acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,2,7.0 7190,1932,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_2_2proton2acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,2,7.0 7191,1932,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_2_2proton2acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,2,7.0 7192,1932,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_2_2proton2acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,2,7.0 7193,1932,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_2_2proton2acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,2,7.0 7194,1932,1127,Fatty acids,Fatty Acids and Conjugates,Acyclic monoterpenoids,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_2_2proton2acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Ranunculus sceleratus,747491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sceleratus'],6,2,7.0 7195,1930,-1,,,,0.30168998,ISDB,QQMDGBRVBLDRAM-QGZVFWFLSA-N,"InChI=1S/C22H24O7/c1-13(2)17(29-24)7-5-14(3)9-11-27-22-20-16(10-12-26-20)19(25-4)15-6-8-18(23)28-21(15)22/h6,8-10,12,17,24H,1,5,7,11H2,2-4H3/t17-/m1/s1",C=C(C)[C@@H](CCC(C)=CCOc1c2occc2c(OC)c2ccc(=O)oc12)OO,C22H24O7,,400.152203108,QQMDGBRVBLDRAM,Shikimates and Phenylpropanoids,Coumarins,Furocoumarins,Melicope triphylla,710074.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Melicope'],['Melicope triphylla'],4,0,5.206759929656982 7196,1927,1097,Fatty acids,Diterpenoids,Fatty ethers,0.58854806,ISDB,ZHADMZSKNJUERU-BWLZIVRNSA-N,"InChI=1S/C19H30O3/c1-3-4-5-6-8-11-14-17-22-18-15-12-9-7-10-13-16-19(20)21-2/h4-5,8,11,14-15,17-18H,3,6-7,9-10,12-13,16H2,1-2H3/b5-4-,11-8-,17-14+,18-15+",CC/C=C\C/C=C\C=C\O/C=C/CCCCCCC(=O)OC,C19H30O3,,306.21949482,ZHADMZSKNJUERU,Fatty acids,Fatty acyls,Fatty ethers,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,7.85419225692749 7197,1918,921,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,0.0,MS1_match,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,pos_1_1proton1methanol,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7198,1918,921,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,0.0,MS1_match,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,pos_1_1proton1methanol,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7199,1918,921,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,0.0,MS1_match,VMYXUZSZMNBRCN-UHFFFAOYSA-N,"InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3",CC(C)=CCCC(C)c1ccc(C)cc1,C15H22,pos_1_1proton1methanol,202.172150704,VMYXUZSZMNBRCN,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,3,7.5 7200,1915,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.58757764,ISDB,VAGGDCACZPJMFS-OPOXAECZSA-N,"InChI=1S/C19H36O5/c1-3-4-5-9-12-17(21)18(22)15-14-16(20)11-8-6-7-10-13-19(23)24-2/h14-18,20-22H,3-13H2,1-2H3/b15-14+/t16-,17+,18+/m1/s1",CCCCCC[C@H](O)[C@@H](O)/C=C/[C@H](O)CCCCCCC(=O)OC,C19H36O5,,344.256274252,VAGGDCACZPJMFS,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Sambucus williamsii,589181.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Sambucus'],['Sambucus williamsii'],5,3,8.850310564041138 7201,1911,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.47733334,ISDB,,,,,,,CSXCBIKURHSKER,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.909333348274231 7202,1909,-1,,,,0.30037358,ISDB,,,,,,,BENRMCVWICIKQJ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2014943361282349 7203,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_1_1proton,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7204,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_1_1proton,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 7205,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_1_1proton,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 7206,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton,462.116211524,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,2,7.0 7207,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_1_1proton,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia olgae,6061317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olgae'],6,2,7.0 7208,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_1_1proton,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Scabiosa atropurpurea,900954.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa atropurpurea'],6,2,7.0 7209,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton,462.116211524,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria gigantea,3892199.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria gigantea'],6,2,7.0 7210,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_1_1proton,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia olgae,6061317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia olgae'],6,2,7.0 7211,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,JSUJHPSAVAWXEN-SNRPTINQSA-N,"InChI=1S/C22H22O11/c1-30-14-7-13-16(11(25)6-12(31-13)9-2-4-10(24)5-3-9)18(27)21(14)33-22-20(29)19(28)17(26)15(8-23)32-22/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22+/m0/s1",COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C22H22O11,pos_1_1proton,462.1162115239998,JSUJHPSAVAWXEN,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Scabiosa atropurpurea,900954.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa atropurpurea'],6,2,7.0 7212,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton,462.116211524,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria leucantha,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 7213,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria uralensis,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 7214,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus papposus,450630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus papposus'],6,2,7.0 7215,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus plumosus,5746454.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus plumosus'],6,2,7.0 7216,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7217,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7218,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-UHFFFAOYSA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1C1OC(CO)C(O)C(O)C1O,C22H22O11,pos_1_1proton,462.116211524,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria leucantha,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 7219,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria uralensis,518016.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria leucantha'],6,2,7.0 7220,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus papposus,450630.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus papposus'],6,2,7.0 7221,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Pterocephalus plumosus,5746454.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Pterocephalus'],['Pterocephalus plumosus'],6,2,7.0 7222,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7223,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DLVLXOYLQKCAME-DGHBBABESA-N,"InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1",COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C22H22O11,pos_1_1proton,462.1162115239999,DLVLXOYLQKCAME,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7224,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_1_1proton,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7225,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_1_1proton,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7226,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,YXHFXGHAELQJGK-NYIAETJKSA-N,"InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19+,20?,22-/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3o2)ccc1O,C22H22O11,pos_1_1proton,462.116211524,YXHFXGHAELQJGK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 7227,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_1_1proton,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 7228,1908,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,WKUHPOMCLBLCOV-MIUGBVLSSA-N,"InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C22H22O11,pos_1_1proton,462.1162115239998,WKUHPOMCLBLCOV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 7229,1904,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.25830838,ISDB,KOJDHHJUQBZUHA-HMNPXLOQSA-N,"InChI=1S/C22H34ClNO5/c1-3-4-5-6-7-8-9-10-11-12-19(26)24-16-15-22(28)18(25)14-13-17(23)21(22,2)29-20(16)27/h11-14,16-17,20,27-28H,3-10,15H2,1-2H3,(H,24,26)/t16-,17+,20+,21-,22+/m0/s1",CCCCCCCCCC=CC(=O)N[C@H]1C[C@@]2(O)C(=O)C=C[C@@H](Cl)[C@]2(C)O[C@H]1O,C22H34ClNO5,,427.212550868,KOJDHHJUQBZUHA,Alkaloids,Pseudoalkaloids,Isariotin alkaloids,Cordyceps tenuipes,590328.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Cordycipitaceae'],['Unknown'],['Cordyceps'],['Cordyceps polyarthra'],1,0,2.0332335233688354 7230,1904,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.25830838,ISDB,KOJDHHJUQBZUHA-HMNPXLOQSA-N,"InChI=1S/C22H34ClNO5/c1-3-4-5-6-7-8-9-10-11-12-19(26)24-16-15-22(28)18(25)14-13-17(23)21(22,2)29-20(16)27/h11-14,16-17,20,27-28H,3-10,15H2,1-2H3,(H,24,26)/t16-,17+,20+,21-,22+/m0/s1",CCCCCCCCCC=CC(=O)N[C@H]1C[C@@]2(O)C(=O)C=C[C@@H](Cl)[C@]2(C)O[C@H]1O,C22H34ClNO5,,427.212550868,KOJDHHJUQBZUHA,Alkaloids,Pseudoalkaloids,Isariotin alkaloids,Isaria tenuipes,590328.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Cordycipitaceae'],['Unknown'],['Cordyceps'],['Cordyceps polyarthra'],1,0,2.0332335233688354 7231,1902,375,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XNBHVNRFMHXLMZ-ODLFONTESA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19+,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_1_1proton,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 7232,1902,375,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XNBHVNRFMHXLMZ-ODLFONTESA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19+,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_1_1proton,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia saniculifolia,139326.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia saniculifolia'],6,3,7.5 7233,1902,375,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,XNBHVNRFMHXLMZ-FJSYSMJUSA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19-,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_1_1proton,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 7234,1902,375,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BYWPUNIXQZJWRS-UHFFFAOYSA-N,"InChI=1S/C10H16O3/c1-5-6-3-8(11)10(2)7(6)4-12-9(5)13-10/h5-9,11H,3-4H2,1-2H3",CC1C2OCC3C1CC(O)C3(C)O2,C10H16O3,pos_2MH,184.109944372,BYWPUNIXQZJWRS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7235,1902,375,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BYWPUNIXQZJWRS-RSMBCMNPSA-N,"InChI=1S/C10H16O3/c1-5-6-3-8(11)10(2)7(6)4-12-9(5)13-10/h5-9,11H,3-4H2,1-2H3/t5-,6+,7+,8-,9-,10-/m0/s1",C[C@@H]1[C@H]2OC[C@@H]3[C@@H]1C[C@H](O)[C@@]3(C)O2,C10H16O3,pos_2MH,184.109944372,BYWPUNIXQZJWRS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 7236,1902,375,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KCIYXMDQXNFJBA-BDNRQGISSA-N,"InChI=1S/C10H16O3/c1-6-7-3-4-10(2,12)8(7)5-13-9(6)11/h6-8,12H,3-5H2,1-2H3/t6-,7-,8+,10-/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1CC[C@@]2(C)O,C10H16O3,pos_2MH,184.109944372,KCIYXMDQXNFJBA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 7237,1901,1346,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NGSWKAQJJWESNS-UHFFFAOYSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)",O=C(O)C=Cc1ccc(O)cc1,C9H8O3,pos_1_1proton2acetonitrile,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 7238,1900,282,Alkaloids,Tyrosine alkaloids,Cinnamic acid amides,0.7634019,ISDB,FNYIPYRLIHJQLI-INIZCTEOSA-N,"InChI=1S/C18H19NO2/c1-21-18-9-13-6-7-19-11-14-5-3-2-4-12(14)8-16(19)15(13)10-17(18)20/h2-5,9-10,16,20H,6-8,11H2,1H3/t16-/m0/s1",COc1cc2c(cc1O)[C@@H]1Cc3ccccc3CN1CC2,C18H19NO2,,281.141578848,FNYIPYRLIHJQLI,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Argemone mexicana,408476.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Argemone'],['Argemone mexicana'],5,2,9.053607702255249 7239,1894,-1,,,,0.6082631,ISDB,RGSJIRHIGRUMOQ-FKAKKMJLSA-N,"InChI=1S/C21H32O3/c1-13-6-7-19-20(2,3)8-5-9-21(19,4)16(13)12-18(24)15-10-14(22)11-17(15)23/h6,10,16-19,23-24H,5,7-9,11-12H2,1-4H3/t16-,17-,18-,19-,21+/m1/s1",CC1=CC[C@@H]2C(C)(C)CCC[C@@]2(C)[C@@H]1C[C@@H](O)C1=CC(=O)C[C@H]1O,C21H32O3,,332.235144884,RGSJIRHIGRUMOQ,Terpenoids,Diterpenoids,,Ageratum fastigiatum,5920790.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Ageratum'],['Ageratum fastigiatum'],4,0,6.43305230140686 7240,1891,1117,Polyketides,Sesquiterpenoids,Valerenane sesquiterpenoids,0.5312964,ISDB,DPHXIYPTUGEXJY-MRPWLJHASA-N,"InChI=1S/C15H18O6/c1-3-4-5-9(2)6-7-10(16)13-14(19)11(8-12(17)18)21-15(13)20/h6-9,19H,3-5H2,1-2H3,(H,17,18)/b7-6+,11-8-/t9-/m1/s1",CCCC[C@@H](C)/C=C/C(=O)C1=C(O)/C(=C/C(=O)O)OC1=O,C15H18O6,,294.110338296,DPHXIYPTUGEXJY,Polyketides,Linear polyketides,,Penicillium italicum,6232.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium italicum'],0,1,2.625185489654541 7241,1890,-1,,,,0.20238124,ISDB,,,,,,,MITNBWXSDQNKSU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8095249533653259 7242,1889,-1,,,,0.0,MS1_match,YPZQHCLBLRWNMJ-OPRDCNLKSA-N,"InChI=1S/C10H16O2/c1-4-10(3)6-5-9(12-10)8(2)7-11/h4,7-9H,1,5-6H2,2-3H3/t8-,9-,10-/m1/s1",C=C[C@]1(C)CC[C@H]([C@H](C)C=O)O1,C10H16O2,pos_2MH,168.115029752,YPZQHCLBLRWNMJ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7243,1888,394,Fatty acids,Fatty amides,Wax monoesters,0.3779016,ISDB,,,,,,,CQOAKBVRRVHWKV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5116064548492432 7244,1878,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,GJOKUHOJKKOIEW-UHFFFAOYSA-N,"InChI=1S/C12H14O6/c1-7(4-13)12(17)3-11(18-8(2)16)9(5-14)10(12)6-15/h4,6,11,14,17H,1,3,5H2,2H3",C=C(C=O)C1(O)CC(OC(C)=O)C(CO)=C1C=O,C12H14O6,pos_1_1proton1methanol,254.079038168,GJOKUHOJKKOIEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7245,1876,1361,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,0.33464235,ISDB,MLWZOEODCMKKCC-RZNBLONSSA-N,"InChI=1S/C23H38O4/c1-15(25)27-19-9-10-21(4)17(20(19,2)3)8-11-22-12-16(6-7-18(21)22)23(13-22,14-24)26-5/h16-19,24H,6-14H2,1-5H3/t16-,17-,18+,19-,21-,22+,23-/m1/s1",CO[C@@]1(CO)C[C@@]23CC[C@@H]4C(C)(C)[C@H](OC(C)=O)CC[C@@]4(C)[C@@H]2CC[C@@H]1C3,C23H38O4,,378.277009696,MLWZOEODCMKKCC,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Fritillaria anhuiensis,117448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Liliaceae'],['Unknown'],['Fritillaria'],['Fritillaria anhuiensis'],4,3,6.838569402694702 7246,1875,126,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.2149728,ISDB,,,,,,,ZTBYPIBZNSMFBV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8598911762237549 7247,1868,590,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.3322751,ISDB,LAXQYRRMGGEGOH-JXRLJXCWSA-N,"InChI=1S/C28H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(31)34-25-27(30)26-36-37(32,33)35-24-23-29(2,3)4/h9-10,12-13,15-16,18-19,27,30H,5-8,11,14,17,20-26H2,1-4H3/b10-9-,13-12-,16-15-,19-18-/t27-/m1/s1",CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C28H50NO7P,,543.33248957,LAXQYRRMGGEGOH,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,3,3.8291003704071045 7248,1866,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.6997379,ISDB,FIZZAWTVIDYQPI-TUAOUCFPSA-N,"InChI=1S/C12H18O/c1-9-5-3-4-6-11-10(9)7-8-12(11,2)13/h4,6,10-11,13H,1,3,5,7-8H2,2H3/t10-,11+,12-/m0/s1",C=C1CCC=C[C@@H]2[C@H]1CC[C@]2(C)O,C12H18O,,178.135765196,FIZZAWTVIDYQPI,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Dictamnus dasycarpus,651514.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Dictamnus'],['Dictamnus dasycarpus'],4,2,7.798951625823975 7249,1865,364,Alkaloids,Tryptophan alkaloids,Quinoline alkaloids,0.60049677,ISDB,WJFJWQGKFWQXLB-NWDGAFQWSA-N,"InChI=1S/C14H17NO6/c1-21-12-2-3-13(19)15-14(20)11(18)5-7-4-9(16)10(17)6-8(7)12/h4,6,11-12,16-18H,2-3,5H2,1H3,(H,15,19,20)/t11-,12+/m0/s1",CO[C@@H]1CCC(=O)NC(=O)[C@@H](O)Cc2cc(O)c(O)cc21,C14H17NO6,,295.105587264,WJFJWQGKFWQXLB,Alkaloids,Lysine alkaloids,,Salvia miltiorrhiza,847543.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia miltiorrhiza'],4,1,6.901987075805664 7250,1864,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1ammonium,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,3,7.5 7251,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Zanthoxylum petiolare,5747734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum petiolare'],4,1,6.110862851142883 7252,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-UHFFFAOYSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)",CCCCCC=CCCC=CC=CC(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Piper chaba,505281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper retrofractum'],4,1,6.110862851142883 7253,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Leucocyclus formosus,616330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Leucocyclus'],['Leucocyclus formosus'],4,1,6.110862851142883 7254,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Achillea formosa,4416.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Achillea'],['Achillea formosa'],4,1,6.110862851142883 7255,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Piper formosum,6030745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper formosum'],4,1,6.110862851142883 7256,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Piper retrofractum,505281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper retrofractum'],4,1,6.110862851142883 7257,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Achillea nana,395148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Achillea'],['Achillea nana'],4,1,6.110862851142883 7258,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Otanthus maritimus,195139.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Otanthus'],['Otanthus maritimus'],4,1,6.110862851142883 7259,1858,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.4027157,ISDB,RVYUTDKHUFWTFC-RFYAXJIXSA-N,"InChI=1S/C18H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3,(H,19,20)/b9-8-,13-12+,15-14+",CCCCC/C=C\CC/C=C/C=C/C(=O)NCC(C)C,C18H31NO,,277.240564612,RVYUTDKHUFWTFC,Fatty acids,Fatty amides,N-acyl amines,Achillea maritima,869832.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Achillea'],['Achillea maritima'],4,1,6.110862851142883 7260,1855,-1,,,,0.0,MS1_match,ZNFRITHWVZXJRK-YHFBEQRYSA-N,"InChI=1S/C36H58O8/c1-31(2)14-16-36(30(41)42)17-15-34(6)20(21(36)18-31)8-9-24-33(5)12-11-25(32(3,4)23(33)10-13-35(24,34)7)44-29-28(40)27(39)26(38)22(19-37)43-29/h8,21-29,37-40H,9-19H2,1-7H3,(H,41,42)/t21-,22+,23-,24+,25-,26+,27-,28+,29-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H58O8,pos_1_1proton1isopropanol,618.413168816,ZNFRITHWVZXJRK,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis grata,5922971.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis grata'],8,0,8.0 7261,1853,1361,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,0.0,MS1_match,JIACKIXQFVBLBK-NPPFBWRTSA-N,"InChI=1S/C22H34O3/c1-13(2)19-16(24-6)12-15-14(20(19)25-7)8-9-17-21(3,4)18(23)10-11-22(15,17)5/h12-13,17-18,23H,8-11H2,1-7H3/t17-,18-,22+/m0/s1",COc1cc2c(c(OC)c1C(C)C)CC[C@H]1C(C)(C)[C@@H](O)CC[C@]21C,C22H34O3,pos_1_1proton1methanol,346.250794948,JIACKIXQFVBLBK,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Tripterygium hypoglaucum,906992.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium hypoglaucum'],6,2,7.0 7262,1853,1361,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,0.0,MS1_match,JIACKIXQFVBLBK-NPPFBWRTSA-N,"InChI=1S/C22H34O3/c1-13(2)19-16(24-6)12-15-14(20(19)25-7)8-9-17-21(3,4)18(23)10-11-22(15,17)5/h12-13,17-18,23H,8-11H2,1-7H3/t17-,18-,22+/m0/s1",COc1cc2c(c(OC)c1C(C)C)CC[C@H]1C(C)(C)[C@@H](O)CC[C@]21C,C22H34O3,pos_1_1proton1methanol,346.250794948,JIACKIXQFVBLBK,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,2,7.0 7263,1852,1405,Terpenoids,Diterpenoids,Labdane diterpenoids,0.3855193,ISDB,PUEYPOOQZNJSBJ-SOKBWVMISA-N,"InChI=1S/C25H38O4/c1-6-17(2)23(27)29-22-11-13-24(4)20(9-8-19-12-14-28-15-19)18(3)7-10-21(24)25(22,5)16-26/h6,12,20-22,26H,3,7-11,13-16H2,1-2,4-5H3/b17-6-/t20-,21+,22-,24+,25-/m1/s1",C=C1CC[C@H]2[C@@](C)(CC[C@@H](OC(=O)/C(C)=C\C)[C@]2(C)CO)[C@@H]1CCC1=CCOC1,C25H38O4,,402.277009696,PUEYPOOQZNJSBJ,Terpenoids,Diterpenoids,Labdane diterpenoids,Gutierrezia solbrigii,7599156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Gutierrezia'],['Gutierrezia solbrigii'],4,3,7.04207718372345 7264,1851,-1,,,,0.24526131,ISDB,NDFUYJPVVCJYNZ-HTDBADMHSA-N,"InChI=1S/C21H30O10/c1-11(6-15(24)25)4-5-21(29)12(2)7-13(23)8-20(21,3)10-30-19-18(28)17(27)16(26)14(9-22)31-19/h4-7,14,16-19,22,26-29H,8-10H2,1-3H3,(H,24,25)/b5-4+,11-6-/t14-,16-,17-,18-,19+,20+,21+/m0/s1",CC1=CC(=O)C[C@](C)(CO[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@]1(O)/C=C/C(C)=C\C(=O)O,C21H30O10,,442.18389716,NDFUYJPVVCJYNZ,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Persea americana,913249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Persea'],['Persea americana'],4,0,4.981045246124268 7265,1850,118,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,PLUVLWUSXQCTNH-UHFFFAOYSA-N,"InChI=1S/C15H20O3/c1-5-6-12-7-8-13(14(10-12)17-4)18-15(16)9-11(2)3/h5,7-8,10-11H,1,6,9H2,2-4H3",C=CCc1ccc(OC(=O)CC(C)C)c(OC)c1,C15H20O3,pos_1_1proton,248.1412445,PLUVLWUSXQCTNH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7266,1848,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.42110467,ISDB,AGHYYIRUYLLBAR-DOTOQJQBSA-N,"InChI=1S/C19H32O4/c1-15(20)9-7-5-3-2-4-6-8-10-17(21)11-16-12-18(22)14-19(23)13-16/h12-15,17,20-23H,2-11H2,1H3/t15-,17+/m0/s1",C[C@H](O)CCCCCCCCC[C@@H](O)Cc1cc(O)cc(O)c1,C19H32O4,,324.230059504,AGHYYIRUYLLBAR,Polyketides,,,Ononis pubescens,323322.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis pubescens'],4,0,5.684418678283691 7267,1846,-1,,,,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_1proton1methanol,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7268,1846,-1,,,,0.0,MS1_match,KVSQIVFQSWVUGM-GHADIOTFSA-N,"InChI=1S/C21H36O8/c1-9-5-12(23)15-10(9)6-11-13(7-21(15,4)29-20(11,2)3)27-19-18(26)17(25)16(24)14(8-22)28-19/h9-19,22-26H,5-8H2,1-4H3/t9-,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]2(C)OC1(C)C,C21H36O8,pos_1_1proton1methanol,416.241018112,KVSQIVFQSWVUGM,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 7269,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7270,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 7271,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 7272,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 7273,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7274,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 7275,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 7276,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,3,7.5 7277,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_1proton1ammonium,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 7278,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7279,1844,719,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1ammonium,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 7280,1842,-1,,,,0.0,MS1_match,HKZQJZIFODOLFR-UHFFFAOYSA-N,"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h6H,4-5H2,1-3H3",CC1=CC(=O)C(=C(C)C)CC1,C10H14O,pos_1_1proton1acetonitrile,150.104465068,HKZQJZIFODOLFR,Terpenoids,Monoterpenoids,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7281,1842,-1,,,,0.0,MS1_match,RECUKUPTGUEGMW-UHFFFAOYSA-N,"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3",Cc1ccc(C(C)C)cc1O,C10H14O,pos_1_1proton1acetonitrile,150.104465068,RECUKUPTGUEGMW,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7282,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-UHFFFAOYSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3",Cc1ccc2c(c1)C(C(C)C)=CCC2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Cyperus,266228.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Cyperaceae'],['Cypereae'],['Cyperus'],['Unknown'],4,3,8.618499517440796 7283,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-UHFFFAOYSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3",Cc1ccc2c(c1)C(C(C)C)=CCC2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Pilocarpus riedelianus,6125579.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Pilocarpus'],['Pilocarpus riedelianus'],4,3,8.618499517440796 7284,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-GFCCVEGCSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3/t12-/m1/s1",Cc1ccc2c(c1)C(C(C)C)=CC[C@H]2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Cyperus rotundus,338773.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Cyperaceae'],['Cypereae'],['Cyperus'],['Cyperus rotundus'],4,3,8.618499517440796 7285,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-LBPRGKRZSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3/t12-/m0/s1",Cc1ccc2c(c1)C(C(C)C)=CC[C@@H]2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Schinus molle,411495.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Schinus'],['Schinus molle'],4,3,8.618499517440796 7286,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-LBPRGKRZSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3/t12-/m0/s1",Cc1ccc2c(c1)C(C(C)C)=CC[C@@H]2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Uvaria chamae,340656.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Uvaria'],['Uvaria chamae'],4,3,8.618499517440796 7287,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-UHFFFAOYSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3",Cc1ccc2c(c1)C(C(C)C)=CCC2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Acorus calamus,1008193.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Acorales'],['Acoraceae'],['Unknown'],['Acorus'],['Acorus calamus'],4,3,8.618499517440796 7288,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-UHFFFAOYSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3",Cc1ccc2c(c1)C(C(C)C)=CCC2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Lithraea molleoides,556811.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Lithrea'],['Lithrea molleoides'],4,3,8.618499517440796 7289,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-LBPRGKRZSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3/t12-/m0/s1",Cc1ccc2c(c1)C(C(C)C)=CC[C@@H]2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Bupleurum acutifolium,884713.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Bupleureae'],['Bupleurum'],['Bupleurum acutifolium'],4,3,8.618499517440796 7290,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-UHFFFAOYSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3",Cc1ccc2c(c1)C(C(C)C)=CCC2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Humulus lupulus,84020.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Humulus'],['Humulus lupulus'],4,3,8.618499517440796 7291,1841,648,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.7796249,ISDB,YLIAZCIBLKJTKN-LBPRGKRZSA-N,"InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7-10,12H,6H2,1-4H3/t12-/m0/s1",Cc1ccc2c(c1)C(C(C)C)=CC[C@@H]2C,C15H20,,200.15650064,YLIAZCIBLKJTKN,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Cleistopholis patens,3867599.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Unknown'],['Cleistopholis'],['Cleistopholis patens'],4,3,8.618499517440796 7292,1839,-1,,,,0.644086,ISDB,OSULXBNEGGTCCA-XXGPQQRCSA-N,"InChI=1S/C20H26O2/c1-11-14-8-12-4-5-17-19(2,7-6-13-10-20(13,17)3)15(12)9-16(14)22-18(11)21/h8,13,15-17H,4-7,9-10H2,1-3H3/t13-,15-,16-,17+,19+,20+/m1/s1",CC1=C2C=C3CC[C@@H]4[C@@]5(C)C[C@H]5CC[C@@]4(C)[C@@H]3C[C@H]2OC1=O,C20H26O2,,298.193280072,OSULXBNEGGTCCA,Terpenoids,Diterpenoids,Cycloabietane diterpenoids,Suregada glomerulata,1082259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Gelonieae'],['Suregada'],['Suregada glomerulata'],4,0,6.576344013214111 7293,1835,-1,,,,0.0,MS1_match,HFPZCAJZSCWRBC-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3",Cc1ccc(C(C)C)cc1,C10H14,pos_1_1proton,134.109550448,HFPZCAJZSCWRBC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 7294,1835,-1,,,,0.0,MS1_match,HFPZCAJZSCWRBC-UHFFFAOYSA-N,"InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3",Cc1ccc(C(C)C)cc1,C10H14,pos_1_1proton,134.109550448,HFPZCAJZSCWRBC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7295,1833,-1,,,,0.46237677,ISDB,NFQCORXWZVREFM-JYCBUDTGSA-N,"InChI=1S/C43H58O6/c1-26(2)13-12-21-41(11)33(18-15-28(5)6)25-42(24-32(30(9)10)16-14-27(3)4)38(47)36(37(46)31-17-19-34(44)35(45)23-31)39(48)43(41,40(42)49)22-20-29(7)8/h13,15,17,19-20,23,32-33,44-46H,3,9,12,14,16,18,21-22,24-25H2,1-2,4-8,10-11H3/b37-36+/t32?,33-,41+,42-,43+/m0/s1",C=C(C)CCC(C[C@]12C[C@H](CC=C(C)C)[C@@](C)(CCC=C(C)C)[C@](CC=C(C)C)(C(=O)/C(=C(/O)c3ccc(O)c(O)c3)C1=O)C2=O)C(=C)C,C43H58O6,,670.423339576,NFQCORXWZVREFM,Polyketides,Meroterpenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),Symphonia globulifera,978306.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Symphonieae'],['Symphonia'],['Symphonia globulifera'],4,0,5.849507093429565 7296,1831,-1,,,,0.46333808,ISDB,BITHHVVYSMSWAG-KTKRTIGZSA-N,"InChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10H,2-8,11-19H2,1H3,(H,21,22)/b10-9-",CCCCCCCC/C=C\CCCCCCCCCC(=O)O,C20H38O2,,310.287180456,BITHHVVYSMSWAG,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium fissum,833960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium fissum'],6,0,7.853352308273315 7297,1831,-1,,,,0.46333808,ISDB,BITHHVVYSMSWAG-KTKRTIGZSA-N,"InChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10H,2-8,11-19H2,1H3,(H,21,22)/b10-9-",CCCCCCCC/C=C\CCCCCCCCCC(=O)O,C20H38O2,,310.287180456,BITHHVVYSMSWAG,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium schmalhausenii,7591251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium schmalhausenii'],6,0,7.853352308273315 7298,1827,940,,,,0.53171355,ISDB,,,,,,,BIKJRUMCRBPQKR,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.126854181289673 7299,1825,-1,,,,0.0,MS1_match,QLASPINFLLNESN-UVBAXCRRSA-N,"InChI=1S/C15H22O4/c1-8-5-9(16)6-10-11(17)7-12-13(15(8,10)4)14(2,3)19-18-12/h6,8-9,12-13,16H,5,7H2,1-4H3/t8-,9-,12-,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C[C@H]3OOC(C)(C)[C@H]3[C@]21C,C15H22O4,pos_1_1proton1methanol,266.151809184,QLASPINFLLNESN,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7300,1825,-1,,,,0.0,MS1_match,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,pos_1_1proton1methanol,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 7301,1825,-1,,,,0.0,MS1_match,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,pos_1_1proton1methanol,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana officinalis var. latifolia,430697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7302,1825,-1,,,,0.0,MS1_match,AFMMLDAVYSFRHS-HGNGLJKMSA-N,"InChI=1S/C15H22O4/c1-14(2)9-6-7-15(3)8(4-5-10(16)19-15)11(12(9)14)13(17)18/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)/t8-,9-,11-,12-,15-/m0/s1",CC1(C)[C@@H]2[C@@H](C(=O)O)[C@@H]3CCC(=O)O[C@@]3(C)CC[C@@H]21,C15H22O4,pos_1_1proton1methanol,266.151809184,AFMMLDAVYSFRHS,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7303,1825,-1,,,,0.0,MS1_match,NFAIEEHBPOJNKN-IPRJDCTKSA-N,"InChI=1S/C15H22O4/c1-7-5-8(16)6-9-10(17)11-12(19-11)13(14(2,3)18)15(7,9)4/h6-8,11-13,16,18H,5H2,1-4H3/t7-,8-,11-,12-,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)[C@H]3O[C@H]3[C@@H](C(C)(C)O)[C@]21C,C15H22O4,pos_1_1proton1methanol,266.151809184,NFAIEEHBPOJNKN,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7304,1825,-1,,,,0.0,MS1_match,ZSRVBNXAPSQDFY-PLJUSGQGSA-N,"InChI=1S/C15H22O4/c1-9-3-4-14(7-16)11(5-9)19-12-6-10(17)13(14,2)15(12)8-18-15/h5,10-12,16-17H,3-4,6-8H2,1-2H3/t10-,11-,12-,13+,14-,15-/m1/s1",CC1=C[C@H]2O[C@@H]3C[C@@H](O)[C@@](C)([C@@]2(CO)CC1)[C@@]31CO1,C15H22O4,pos_1_1proton1methanol,266.151809184,ZSRVBNXAPSQDFY,Terpenoids,Sesquiterpenoids,Trichothecane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7305,1825,-1,,,,0.0,MS1_match,BDBRZURCDWHOCK-GBALPHGKSA-N,"InChI=1S/C15H22O4/c1-8(2)15-6-5-14(4,18-19-15)12-10(16)7-9(3)11(12)13(15)17/h8-9,13,17H,5-7H2,1-4H3/t9-,13+,14+,15+/m1/s1",CC(C)[C@]12CC[C@](C)(OO1)C1=C([C@H](C)CC1=O)[C@@H]2O,C15H22O4,pos_1_1proton1methanol,266.151809184,BDBRZURCDWHOCK,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7306,1823,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.39218065,ISDB,JAKAZHIACKJNNB-RTBURBONSA-N,"InChI=1S/C19H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h1,18-19,21-22H,4-16H2,2H3/t18-,19-/m1/s1",C#CCCCCCCCCCCC[C@@H](O)C[C@@H](O)COC(C)=O,C19H34O4,,326.24570956799994,JAKAZHIACKJNNB,Fatty acids,Fatty acyls,Fatty alcohols,Persea americana,913249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Persea'],['Persea americana'],4,0,5.568722605705261 7307,1822,799,Fatty acids,Fatty esters,Wax monoesters,0.36873233,ISDB,,,,,,,MXSVVKSZJQKNBC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4749293327331543 7308,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7309,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 7310,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 7311,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 7312,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7313,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 7314,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-QPCLWJSESA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3/t11-,12+,13+,14-,16+,17-,18+,19-,20+,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@H](CO)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 7315,1820,-1,,,,0.0,MS1_match,BGDMXWQJUGENQP-UHFFFAOYSA-N,"InChI=1S/C21H34O11/c1-9(2)3-15(25)32-20-16-11(4-13(24)12(16)5-22)10(7-29-20)8-30-21-19(28)18(27)17(26)14(6-23)31-21/h7,9,11-14,16-24,26-28H,3-6,8H2,1-2H3",CC(C)CC(=O)OC1OC=C(COC2OC(CO)C(O)C(O)C2O)C2CC(O)C(CO)C12,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,BGDMXWQJUGENQP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabiosifolia,231856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabiosifolia'],6,0,6.0 7316,1820,-1,,,,0.0,MS1_match,RKKLMLPXHGWOKI-FXHXVMKNSA-N,"InChI=1S/C21H34O11/c1-10-5-31-21(11(2)3-4-12(10)21)9-30-18-16(25)15(24)14(23)13(32-18)6-28-19-17(26)20(27,7-22)8-29-19/h3,10,12-19,22-27H,4-9H2,1-2H3/t10-,12-,13-,14-,15+,16-,17+,18-,19-,20-,21-/m1/s1",CC1=CC[C@@H]2[C@H](C)CO[C@]12CO[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H34O11,pos_1_1proton1acetonitrile,462.2101119079999,RKKLMLPXHGWOKI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 7317,1820,-1,,,,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7318,1820,-1,,,,0.0,MS1_match,LANCLZFYVLANQS-RHMPUOGUSA-N,"InChI=1S/C21H34O11/c1-9(2)4-14(24)32-19-15-11(5-13(23)21(15,3)28)10(7-29-19)8-30-20-18(27)17(26)16(25)12(6-22)31-20/h7,9,11-13,15-20,22-23,25-28H,4-6,8H2,1-3H3/t11-,12-,13+,15-,16-,17+,18-,19+,20-,21-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@](C)(O)[C@@H]12,C21H34O11,pos_1_1proton1acetonitrile,462.210111908,LANCLZFYVLANQS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,0,6.0 7319,1817,-1,,,,0.6577552,ISDB,,,,,,,VXUKZOXLZJQOHU,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.6310207843780518 7320,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 7321,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 7322,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-INICUGGLSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium orientale,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 7323,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-INICUGGLSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7324,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-INICUGGLSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 7325,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nudicaule,643530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nudicaule'],6,0,6.0 7326,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7327,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 7328,1814,-1,,,,0.0,MS1_match,QMRUISKQGDXAFF-KZQSOGKNSA-N,"InChI=1S/C23H37NO7/c1-5-24-11-19(25)7-6-16(30-3)22-15(19)8-13(17(22)24)20(26)10-14(29-2)12-9-21(22,27)23(20,28)18(12)31-4/h12-18,25-28H,5-11H2,1-4H3/t12-,13+,14+,15-,16+,17-,18+,19-,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(O)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@]1(O)[C@H]2OC,C23H37NO7,pos_1_1proton1methanol,439.257002524,QMRUISKQGDXAFF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 7329,1814,-1,,,,0.0,MS1_match,QMRUISKQGDXAFF-KZQSOGKNSA-N,"InChI=1S/C23H37NO7/c1-5-24-11-19(25)7-6-16(30-3)22-15(19)8-13(17(22)24)20(26)10-14(29-2)12-9-21(22,27)23(20,28)18(12)31-4/h12-18,25-28H,5-11H2,1-4H3/t12-,13+,14+,15-,16+,17-,18+,19-,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(O)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@]1(O)[C@H]2OC,C23H37NO7,pos_1_1proton1methanol,439.257002524,QMRUISKQGDXAFF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 7330,1814,-1,,,,0.0,MS1_match,QMRUISKQGDXAFF-KZQSOGKNSA-N,"InChI=1S/C23H37NO7/c1-5-24-11-19(25)7-6-16(30-3)22-15(19)8-13(17(22)24)20(26)10-14(29-2)12-9-21(22,27)23(20,28)18(12)31-4/h12-18,25-28H,5-11H2,1-4H3/t12-,13+,14+,15-,16+,17-,18+,19-,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(O)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@]1(O)[C@H]2OC,C23H37NO7,pos_1_1proton1methanol,439.257002524,QMRUISKQGDXAFF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,0,6.0 7331,1814,-1,,,,0.0,MS1_match,DJPVCLSVSGRWRS-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(31-3,15(12)16(11)27)23(29,19(22)24)18(28)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,DJPVCLSVSGRWRS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,0,6.0 7332,1814,-1,,,,0.0,MS1_match,DJPVCLSVSGRWRS-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(31-3,15(12)16(11)27)23(29,19(22)24)18(28)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,DJPVCLSVSGRWRS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7333,1814,-1,,,,0.0,MS1_match,DJPVCLSVSGRWRS-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(31-3,15(12)16(11)27)23(29,19(22)24)18(28)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,DJPVCLSVSGRWRS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 7334,1814,-1,,,,0.0,MS1_match,DJPVCLSVSGRWRS-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(31-3,15(12)16(11)27)23(29,19(22)24)18(28)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,DJPVCLSVSGRWRS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7335,1814,-1,,,,0.0,MS1_match,DJPVCLSVSGRWRS-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(31-3,15(12)16(11)27)23(29,19(22)24)18(28)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,DJPVCLSVSGRWRS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium orientale,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 7336,1814,-1,,,,0.0,MS1_match,DJPVCLSVSGRWRS-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(31-3,15(12)16(11)27)23(29,19(22)24)18(28)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,DJPVCLSVSGRWRS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7337,1814,-1,,,,0.0,MS1_match,DJPVCLSVSGRWRS-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(31-3,15(12)16(11)27)23(29,19(22)24)18(28)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](O)([C@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,DJPVCLSVSGRWRS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 7338,1814,-1,,,,0.0,MS1_match,WXRJWKVQRIKXMW-UHFFFAOYSA-N,"InChI=1S/C23H37NO7/c1-3-6-24-9-20(10-31-2)5-4-14(26)22-12-7-11-13(25)8-21(29,15(12)16(11)27)23(30,19(22)24)18(28)17(20)22/h11-19,25-30H,3-10H2,1-2H3",CCCN1CC2(COC)CCC(O)C34C5CC6C(O)CC(O)(C5C6O)C(O)(C(O)C23)C14,C23H37NO7,pos_1_1proton1methanol,439.257002524,WXRJWKVQRIKXMW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 7339,1814,-1,,,,0.0,MS1_match,IBLZVTWOJQLRST-ALQGZAJVSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-30-2)6-5-14(25)22-13-7-11-12(31-3)8-21(28,23(13,29)19(11)27)15(18(22)24)16(26)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12+,13+,14+,15+,16+,17-,18-,19+,20+,21+,22+,23+/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2[C@@H](O)[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@]1(O)[C@H]2O,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,IBLZVTWOJQLRST,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 7340,1814,-1,,,,0.0,MS1_match,OLEIIQFNFBXIQS-UHFFFAOYSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-30-2)6-5-14(26)22-12-7-11-13(25)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3",CCN1CC2(COC)CCC(O)C34C5CC6C(O)CC(O)(C5C6O)C(O)(C(OC)C23)C14,C23H37NO7,pos_1_1proton1methanol,439.257002524,OLEIIQFNFBXIQS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 7341,1814,-1,,,,0.0,MS1_match,OLEIIQFNFBXIQS-VQTORUAOSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-30-2)6-5-14(26)22-12-7-11-13(25)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16-,17+,18+,19-,20-,21-,22-,23+/m1/s1",CCN1C[C@@]2(COC)CC[C@@H](O)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6O)[C@@](O)([C@H]13)[C@@H](OC)[C@@H]24,C23H37NO7,pos_1_1proton1methanol,439.257002524,OLEIIQFNFBXIQS,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium triste,6131829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium triste'],6,0,6.0 7342,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,0,6.0 7343,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium menziesii,643534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium menziesii'],6,0,6.0 7344,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-XVXCPXLRSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12+,13-,14-,15+,16-,17+,18+,19?,20-,21+,22-,23-/m0/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@]34C1[C@@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 7345,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 7346,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7347,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 7348,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7349,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 7350,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 7351,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 7352,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-XVXCPXLRSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12+,13-,14-,15+,16-,17+,18+,19?,20-,21+,22-,23-/m0/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@]34C1[C@@](O)([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@@H]2C[C@@H]4[C@@H]1[C@H]2O,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 7353,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium menziesii,643534.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium menziesii'],6,0,6.0 7354,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,0,6.0 7355,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 7356,1814,-1,,,,0.0,MS1_match,XZMQBOLTQNBOEK-CGDFZAFZSA-N,"InChI=1S/C23H37NO7/c1-4-24-10-19(11-30-2)6-5-15(31-3)23-12-7-21(28)14(25)9-20(27,16(12)18(21)26)13(17(23)24)8-22(19,23)29/h12-18,25-29H,4-11H2,1-3H3/t12-,13-,14-,15-,16-,17+,18-,19-,20+,21+,22-,23+/m1/s1",CCN1C[C@@]2(COC)CC[C@@H](OC)[C@]34[C@@H]5C[C@]6(O)[C@H](O)C[C@@](O)([C@H]5[C@H]6O)[C@H](C[C@@]23O)[C@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,XZMQBOLTQNBOEK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum var. circinatum,97183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,0,6.0 7357,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-INICUGGLSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium orientale,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 7358,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-INICUGGLSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 7359,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nudicaule,643530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nudicaule'],6,0,6.0 7360,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7361,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-MVQJQBBKSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18-,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 7362,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 7363,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7364,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 7365,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7366,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 7367,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-WBBRWVNZSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.2570025239999,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 7368,1814,-1,,,,0.0,MS1_match,PNKADVXQUJDNSJ-INICUGGLSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19+,20+,21-,22+,23+/m1/s1",CCN1C[C@]2(CO)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@](O)([C@@H](OC)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,PNKADVXQUJDNSJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7369,1814,-1,,,,0.0,MS1_match,YKULCQCEMPRYQG-PLUCXMMOSA-N,"InChI=1S/C23H37NO7/c1-4-24-9-20(10-30-2)6-5-14(25)22-12-7-11-13(31-3)8-21(28,15(12)16(11)26)23(29,19(22)24)18(27)17(20)22/h11-19,25-29H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16-,17-,18+,19+,20+,21-,22+,23-/m1/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](O)[C@H]23)[C@@H]14,C23H37NO7,pos_1_1proton1methanol,439.257002524,YKULCQCEMPRYQG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum delphiniifolium,506023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum delphiniifolium'],6,0,6.0 7370,1813,271,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.5434964,ISDB,SMUVABOERCFKRW-UHFFFAOYSA-N,"InChI=1S/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H3",Cc1ccc(C)c(C=O)c1,C9H10O,,134.07316494,SMUVABOERCFKRW,Terpenoids,,,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,1,6.673985481262207 7371,1811,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.5494556,ISDB,KJSAXQYTHNRIBJ-YRGRVCCFSA-N,"InChI=1S/C14H20O2/c1-10(13(15)16)11-6-8-14(2)7-4-3-5-12(14)9-11/h3,5,11-12H,1,4,6-9H2,2H3,(H,15,16)/t11-,12-,14-/m1/s1",C=C(C(=O)O)[C@@H]1CC[C@@]2(C)CCC=C[C@@H]2C1,C14H20O2,,220.14632988,KJSAXQYTHNRIBJ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Dittrichia graveolens,3899100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Dittrichia'],['Dittrichia graveolens'],4,2,7.197822332382202 7372,1807,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.3159283,ISDB,NMJATLITVAZZIR-CMUKFXBPSA-N,"InChI=1S/C38H75NO5/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-35(41)37(43)34(33-40)39-38(44)36(42)32-30-28-26-24-21-16-14-12-10-8-6-4-2/h17-18,34-37,40-43H,3-16,19-33H2,1-2H3,(H,39,44)/b18-17-/t34-,35+,36+,37-/m0/s1",CCCCCCCC/C=C\CCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO)NC(=O)[C@H](O)CCCCCCCCCCCCCC,C38H75NO5,,625.5645245,NMJATLITVAZZIR,Fatty acids,Sphingolipids,Ceramides,Asterias amurensis,721266.0,['Eukaryota'],['Metazoa'],['Echinodermata'],['Asteroidea'],['Forcipulatida'],['Asteriidae'],['Unknown'],['Asterias'],['Asterias amurensis'],1,2,3.263713240623474 7373,1806,1264,Terpenoids,Macrolides,Macrolide lactones,0.2517643,ISDB,ZPZBRVXCZBYHPI-ITJFIPAGSA-N,"InChI=1S/C24H44O6/c1-19(25)16-22(28)18-23-13-11-9-7-5-3-2-4-6-8-10-12-20(26)17-21(27)14-15-24(29)30-23/h14-15,19-23,25-28H,2-13,16-18H2,1H3/b15-14+/t19-,20+,21-,22-,23+/m1/s1",C[C@@H](O)C[C@@H](O)C[C@@H]1CCCCCCCCCCCC[C@H](O)C[C@H](O)/C=C/C(=O)O1,C24H44O6,,428.313789128,ZPZBRVXCZBYHPI,Polyketides,Macrolides,Macrolide lactones,Hypoxylon rickii,555414.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Xylariales'],['Xylariaceae'],['Unknown'],['Hypoxylon'],['Hypoxylon rickii'],1,3,3.5070571899414062 7374,1796,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7375,1796,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 7376,1796,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,3,7.5 7377,1796,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7378,1796,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,3,7.5 7379,1782,242,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.71069974,ISDB,MNTSOBLYWJLVEK-UHFFFAOYSA-N,"InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-25(39-27(29)10-16)14-1-4-18(5-2-14)38-24-6-3-15(7-19(24)33)26-13-23(37)30-21(35)9-17(32)11-28(30)40-26/h1-13,31-35H",O=c1cc(-c2ccc(Oc3ccc(-c4cc(=O)c5c(O)cc(O)cc5o4)cc3O)cc2)oc2cc(O)cc(O)c12,C30H18O10,,538.089996776,MNTSOBLYWJLVEK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,11.342798948287964 7380,1781,-1,,,,0.25597867,ISDB,OKXGQALERULNCC-JOCHJYFZSA-N,"InChI=1S/C22H28O3/c1-15(2)19-11-13-22(3)12-10-16(4-9-20(19)22)14-25-21(24)17-5-7-18(23)8-6-17/h5-8,10,15,23H,4,9,11-14H2,1-3H3/t22-/m1/s1",CC(C)C1=C2CCC(COC(=O)c3ccc(O)cc3)=CC[C@]2(C)CC1,C22H28O3,,340.203844756,OKXGQALERULNCC,Terpenoids,Sesquiterpenoids,Daucane sesquiterpenoids,Ferula hermonis,470672.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Ferula'],['Ferula hermonis'],4,0,5.023914694786072 7381,1780,-1,,,,0.0,MS1_match,AOGQPLXWSUTHQB-UHFFFAOYSA-N,"InChI=1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3",CCCCCCOC(C)=O,C8H16O2,pos_2MH,144.115029752,AOGQPLXWSUTHQB,Fatty acids,Fatty esters,Wax monoesters,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7382,1779,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_1proton2acetonitrile,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum revolutum,421843.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum revolutum'],6,0,6.0 7383,1779,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_1proton2acetonitrile,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 7384,1779,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_1proton2acetonitrile,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum lucidum,977702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum lucidum'],6,0,6.0 7385,1779,-1,,,,0.0,MS1_match,SRSSHSQCHFGYCO-ACHIHNKUSA-N,"InChI=1S/C38H44N2O6/c1-39-16-14-27-21-36(44-5)37(45-6)23-30(27)31(39)17-24-7-10-28(11-8-24)46-38-19-25(9-12-34(38)42-3)18-32-29-22-33(41)35(43-4)20-26(29)13-15-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32-/m0/s1",COc1cc2c(cc1O)[C@H](Cc1ccc(OC)c(Oc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)cc3)c1)N(C)CC2,C38H44N2O6,pos_1_1proton2acetonitrile,624.319937128,SRSSHSQCHFGYCO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum rugosum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,0,6.0 7386,1778,-1,,,,0.3175374,ISDB,AACOWOOKWQCRBQ-UHFFFAOYSA-N,"InChI=1S/C20H37NO3/c1-16(22)12-10-8-6-4-5-7-9-11-13-19-14-15-20(17(2)21-19)24-18(3)23/h17,19-21H,4-15H2,1-3H3",CC(=O)CCCCCCCCCCC1CCC(OC(C)=O)C(C)N1,C20H37NO3,,339.277344044,AACOWOOKWQCRBQ,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Senna spectabilis,901217.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Senna'],['Senna spectabilis'],4,0,5.2701495885849 7387,1776,-1,,,,0.0,MS1_match,UEGSTWRRIJQNQF-KALOZNMDSA-N,"InChI=1S/C29H46O12/c1-9-38-29(15-30)21(39-19(8)31)12-28(35)20(14-37-27(25(28)29)41-23(33)11-17(4)5)13-36-26(34)24(18(6)7)40-22(32)10-16(2)3/h14,16-18,21,24-25,27,30,35H,9-13,15H2,1-8H3/t21-,24+,25-,27-,28-,29-/m0/s1",CCO[C@@]1(CO)[C@@H](OC(C)=O)C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@H]12,C29H46O12,pos_2_2proton2acetonitrile,586.298926912,UEGSTWRRIJQNQF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7388,1775,-1,,,,0.34720787,ISDB,CDSFEDLMFNBDBT-UHFFFAOYSA-N,"InChI=1S/C12H20O3/c1-2-3-5-8-11(13)9-6-4-7-10-12(14)15/h2H,1,3-10H2,(H,14,15)",C=CCCCC(=O)CCCCCC(=O)O,C12H20O3,,212.1412445,CDSFEDLMFNBDBT,Fatty acids,Fatty Acids and Conjugates,Oxo fatty acids,Apium graveolens,2472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,0,5.3888314962387085 7389,1773,-1,,,,0.0,MS1_match,YDYHOAALGZGNKR-IVTISIJFSA-N,"InChI=1S/C28H40O10/c1-8-18(6)11-25(32)37-22-12-21-20(13-34-19(7)29)14-35-27(38-24(31)10-17(4)5)26(21)28(22,33)15-36-23(30)9-16(2)3/h10,12,14,16,18,22,26-27,33H,8-9,11,13,15H2,1-7H3/t18-,22-,26+,27-,28+/m0/s1",CC[C@H](C)CC(=O)O[C@H]1C=C2C(COC(C)=O)=CO[C@@H](OC(=O)C=C(C)C)[C@@H]2[C@@]1(O)COC(=O)CC(C)C,C28H40O10,pos_1_minus1proton2sodium,536.26214748,YDYHOAALGZGNKR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 7390,1771,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.25550663,ISDB,JXSVEQRKDLWCKF-CCJDVNBRSA-N,"InChI=1S/C32H42O5/c1-17-10-12-31(5)13-11-22-23(29(34)36-27(22)25(31)14-17)16-32(15-20(4)33)24-9-7-18(2)21-8-6-19(3)26(21)28(24)37-30(32)35/h10,21-28H,2-3,6-9,11-16H2,1,4-5H3/t21-,22?,23-,24+,25+,26-,27-,28-,31+,32+/m0/s1",C=C1CC[C@H]2C(=C)CC[C@@H]3[C@H](OC(=O)[C@]3(CC(C)=O)C[C@@H]3C(=O)O[C@H]4C3CC[C@@]3(C)CC=C(C)C[C@H]43)[C@@H]12,C32H42O5,,506.303224444,JXSVEQRKDLWCKF,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Dolomiaea souliei,416979.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Dolomiaea'],['Dolomiaea souliei'],4,3,6.522026538848877 7391,1770,-1,,,,0.0,MS1_match,BSALBDFYJLSIOZ-AJVVGMEXSA-N,"InChI=1S/C29H48O3/c1-18(31)19-9-14-29(17-30)16-15-27(5)20(24(19)29)7-8-22-26(4)12-11-23(32)25(2,3)21(26)10-13-28(22,27)6/h19-24,30,32H,7-17H2,1-6H3/t19-,20+,21-,22+,23+,24+,26-,27+,28+,29+/m0/s1",CC(=O)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C29H48O3,pos_1_1proton1methanol,444.360345396,BSALBDFYJLSIOZ,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,0,7.0 7392,1770,-1,,,,0.0,MS1_match,GXGBLBFUBDIUOT-KZDFMVMNSA-N,"InChI=1S/C29H48O3/c1-19-20(31)7-8-21-25(19,3)10-9-22-26(21,4)12-13-28(6)23-17-24(2,32)11-15-29(23,18-30)16-14-27(22,28)5/h19,21-23,30,32H,7-18H2,1-6H3/t19-,21+,22-,23-,24+,25+,26-,27+,28-,29+/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)CC[C@]3(CO)CC[C@]12C,C29H48O3,pos_1_1proton1methanol,444.360345396,GXGBLBFUBDIUOT,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,0,7.0 7393,1769,531,Fatty acids,Fatty acyls,Hydrocarbons,0.24464607,ISDB,MKBFOWMTLICLPK-UHFFFAOYSA-N,"InChI=1S/C19H41AsO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)21/h4-19H2,1-3H3",CCCCCCCCCCCCCCCCC[As](C)(C)=O,C19H41AsO,,360.237337432,MKBFOWMTLICLPK,Fatty acids,Fatty acyls,Hydrocarbons,Lotus halophilus,998594.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Loteae'],['Lotus'],['Lotus halophilus'],4,3,6.478584289550781 7394,1768,1254,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,0.4431483,ISDB,ZTTWSILEGFVQPN-CQALACEOSA-N,"InChI=1S/C31H48O/c1-19(2)31-16-11-20(3)21(4)27(31)24-9-10-26-28(6)14-13-25(32)22(5)23(28)12-15-30(26,8)29(24,7)17-18-31/h9,20-21,23,25-27,32H,1,5,10-18H2,2-4,6-8H3/t20-,21+,23+,25+,26-,27+,28+,29-,30-,31-/m1/s1",C=C1[C@@H](O)CC[C@]2(C)[C@H]3CC=C4[C@@H]5[C@@H](C)[C@H](C)CC[C@]5(C(=C)C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12,C31H48O,,436.370516156,ZTTWSILEGFVQPN,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Alstonia scholaris,749453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Alstonieae'],['Alstonia'],['Alstonia scholaris'],4,3,7.272593140602112 7395,1766,614,Fatty acids,Glycerophospholipids,Glycerophosphates,0.28718495,ISDB,KTFHNNJQQWKFQS-XSQKZGFSSA-N,"InChI=1S/C27H44O11S/c1-3-14-4-6-16-15-5-7-18-23(19(30)9-11-27(18,13-29)17(15)8-10-26(14,16)2)37-25-22(32)24(38-39(33,34)35)21(31)20(12-28)36-25/h3,14-25,28-32H,1,4-13H2,2H3,(H,33,34,35)/t14-,15-,16-,17-,18-,19-,20+,21+,22+,23+,24-,25-,26-,27-/m0/s1",C=C[C@H]1CC[C@H]2[C@@H]3CC[C@H]4[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](OS(=O)(=O)O)[C@H]5O)[C@@H](O)CC[C@]4(CO)[C@H]3CC[C@@]12C,C27H44O11S,,576.260433228,KTFHNNJQQWKFQS,Terpenoids,Steroids,Pregnane steroids,Ptilocaulis spiculifer,1065726.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Axinellida'],['Axinellidae'],['Unknown'],['Ptilocaulis'],['Ptilocaulis spiculifer'],1,0,2.148739814758301 7396,1764,-1,,,,0.2671267,ISDB,KVHAINOUDBJHJL-VDLPQLTJSA-N,"InChI=1S/C24H48O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-29-18-20(17-25)31-24-23(28)22(27)21(26)19-30-24/h20-28H,2-19H2,1H3/t20-,21-,22-,23+,24+/m1/s1",CCCCCCCCCCCCCCCCOC[C@@H](CO)O[C@@H]1OC[C@@H](O)[C@@H](O)[C@@H]1O,C24H48O7,,448.340003876,KVHAINOUDBJHJL,Fatty acids,Glycerolipids,Monoacylglycerols,Lobophytum crassum,996887.0,['Eukaryota'],['Metazoa'],['Cnidaria'],['Anthozoa'],['Alcyonacea'],['Alcyoniidae'],['Unknown'],['Lobophytum'],['Lobophytum crassum'],1,0,2.0685068368911743 7397,1754,-1,,,,0.0,MS1_match,HMTVXYYWICMXMY-YSVDCJIHSA-N,"InChI=1S/C15H26O3/c1-8-5-11(16)13-9(8)6-10-12(17)7-15(13,4)18-14(10,2)3/h8-13,16-17H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O3,pos_1_1potassium,254.188194692,HMTVXYYWICMXMY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7398,1754,-1,,,,0.0,MS1_match,HMTVXYYWICMXMY-YSVDCJIHSA-N,"InChI=1S/C15H26O3/c1-8-5-11(16)13-9(8)6-10-12(17)7-15(13,4)18-14(10,2)3/h8-13,16-17H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O3,pos_1_1potassium,254.188194692,HMTVXYYWICMXMY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 7399,1752,-1,,,,0.0,MS1_match,RXJRCRXMTRIYTO-HOTIZTCWSA-N,"InChI=1S/C35H58O10/c1-29(2)18-8-9-19-32(6)27(41)25(40)26(31(5)12-10-22(45-31)30(3,4)42)33(32,7)20(37)14-35(19)16-34(18,35)13-11-21(29)44-28-24(39)23(38)17(36)15-43-28/h17-28,36-42H,8-16H2,1-7H3/t17-,18+,19+,20+,21+,22+,23+,24-,25-,26-,27+,28+,31-,32-,33-,34-,35+/m1/s1",CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)[C@H](O)[C@@]3(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46C[C@H](O)[C@]23C)O1,C35H58O10,pos_2_2proton2acetonitrile,638.402998056,RXJRCRXMTRIYTO,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 7400,1748,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.8160516,ISDB,,,,,,,ZMXMVOMPVVLKBY,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.2642064094543457 7401,1744,718,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,0.30463108,ISDB,,,,,,,XQVRPWAJMCYTNW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2185243368148804 7402,1743,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.5831277,ISDB,PYVRVRFVLRNJLY-MZMPXXGTSA-N,"InChI=1S/C23H46NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h9-10,22,25H,2-8,11-21,24H2,1H3,(H,27,28)/b10-9-/t22-/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OCCN,C23H46NO7P,,479.301189442,PYVRVRFVLRNJLY,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,1,3.8325107097625732 7403,1743,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.5831277,ISDB,PYVRVRFVLRNJLY-MZMPXXGTSA-N,"InChI=1S/C23H46NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h9-10,22,25H,2-8,11-21,24H2,1H3,(H,27,28)/b10-9-/t22-/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OCCN,C23H46NO7P,,479.301189442,PYVRVRFVLRNJLY,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,1,3.8325107097625732 7404,1743,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.5831277,ISDB,PYVRVRFVLRNJLY-KTKRTIGZSA-N,"InChI=1S/C23H46NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h9-10,22,25H,2-8,11-21,24H2,1H3,(H,27,28)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)COP(=O)(O)OCCN,C23H46NO7P,,479.301189442,PYVRVRFVLRNJLY,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Ambystoma mexicanum,984726.0,['Eukaryota'],['Metazoa'],['Chordata'],['Amphibia'],['Caudata'],['Ambystomatidae'],['Unknown'],['Ambystoma'],['Ambystoma mexicanum'],1,1,3.8325107097625732 7405,1740,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.3497167,ISDB,NWDBBLFNNILKKJ-MXMFLMJRSA-N,"InChI=1S/C11H18O3/c1-5-11(3,13)8-6-7-9(2)10(12)14-4/h5,7,13H,1,6,8H2,2-4H3/b9-7+/t11-/m1/s1",C=C[C@@](C)(O)CC/C=C(\C)C(=O)OC,C11H18O3,,198.125594436,NWDBBLFNNILKKJ,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Piper aduncum,110421.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper aduncum'],4,1,5.898866772651672 7406,1734,-1,,,,0.53835326,ISDB,XDBXJSPSWNIIHW-RJGRQJGLSA-N,"InChI=1S/C34H38O8/c1-21-12-11-17-24-31(21,2)27(40-29(37)22-13-7-5-8-14-22)28(41-30(38)23-15-9-6-10-16-23)33(4)32(24,3)25(35)18-34(42-33)19-26(36)39-20-34/h5-10,13-16,24-25,27-28,35H,1,11-12,17-20H2,2-4H3/t24-,25-,27-,28-,31-,32-,33-,34-/m0/s1",C=C1CCC[C@H]2[C@@]1(C)[C@@H](OC(=O)c1ccccc1)[C@H](OC(=O)c1ccccc1)[C@]1(C)O[C@@]3(COC(=O)C3)C[C@H](O)[C@]21C,C34H38O8,,574.2566681759998,XDBXJSPSWNIIHW,Terpenoids,,,Scutellaria barbata,1093028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Scutellaria'],['Scutellaria barbata'],4,0,6.1534130573272705 7407,1729,-1,,,,0.0,MS1_match,XXZPXRQPWFAXCK-WQFMGJDKSA-N,"InChI=1S/C17H26O5/c1-10(2)7-15(19)22-17-16-11(3)5-6-14(16)13(9-21-17)8-20-12(4)18/h9-11,14,16-17H,5-8H2,1-4H3/t11-,14+,16+,17-/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1CC[C@@H]2C,C17H26O5,pos_1_1proton,310.178023932,XXZPXRQPWFAXCK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7408,1728,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.6743918,ISDB,LDQHURFLDDRWGZ-UHFFFAOYSA-N,"InChI=1S/C11H14O/c1-8(2)10-6-5-9(3)7-11(10)12-4/h5-7H,1H2,2-4H3",C=C(C)c1ccc(C)cc1OC,C11H14O,,162.104465068,LDQHURFLDDRWGZ,Terpenoids,Monoterpenoids,,Arnica montana,942734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Madieae'],['Arnica'],['Arnica montana'],4,1,7.1975672245025635 7409,1728,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.6743918,ISDB,LDQHURFLDDRWGZ-UHFFFAOYSA-N,"InChI=1S/C11H14O/c1-8(2)10-6-5-9(3)7-11(10)12-4/h5-7H,1H2,2-4H3",C=C(C)c1ccc(C)cc1OC,C11H14O,,162.104465068,LDQHURFLDDRWGZ,Terpenoids,Monoterpenoids,,Calea pilosa,7606941.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea pilosa'],4,1,7.1975672245025635 7410,1727,-1,,,,0.0,MS1_match,DAZJNTWSLAFFAO-KOMCEMOQSA-N,"InChI=1S/C23H34O9/c1-6-14(4)8-18(25)28-10-16-11-29-21(32-19(26)7-13(2)3)20-22(16,27)9-17(31-15(5)24)23(20)12-30-23/h11,13-14,17,20-21,27H,6-10,12H2,1-5H3/t14-,17+,20+,21+,22+,23-/m1/s1",CC[C@@H](C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]3(CO3)[C@@H](OC(C)=O)C[C@]12O,C23H34O9,pos_1_sodium,454.2202826679999,DAZJNTWSLAFFAO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7411,1725,-1,,,,0.0,MS1_match,JHUMCHQLYHVEBX-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(8-29-21-19(28)18(27)17(26)15(7-22)31-21)3-4-11-12(23)6-14(25)16-13(24)5-10(2)30-20(11)16/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(C)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O10,pos_1_1proton1acetonitrile,438.152597032,JHUMCHQLYHVEBX,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 7412,1725,-1,,,,0.0,MS1_match,QIPLCTWVYHJTQK-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(7-22)3-4-11-14(6-13(25)16-12(24)5-10(2)29-20(11)16)30-21-19(28)18(27)17(26)15(8-23)31-21/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(C)oc12)CO,C21H26O10,pos_1_1proton1acetonitrile,438.152597032,QIPLCTWVYHJTQK,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 7413,1725,-1,,,,0.0,MS1_match,QIPLCTWVYHJTQK-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(7-22)3-4-11-14(6-13(25)16-12(24)5-10(2)29-20(11)16)30-21-19(28)18(27)17(26)15(8-23)31-21/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(C)oc12)CO,C21H26O10,pos_1_1proton1acetonitrile,438.152597032,QIPLCTWVYHJTQK,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 7414,1723,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.5568836,ISDB,MIZMWVRZUWPMBI-UHFFFAOYSA-N,"InChI=1S/C20H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h14-19H,2-13H2,1H3,(H2,21,22)",CCCCCCCCCCCCCC=CC=CC=CC(N)=O,C20H35NO,,305.27186474,MIZMWVRZUWPMBI,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Piper longum,97780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper longum'],4,1,6.727534294128418 7415,1718,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,YVVFVJVAHWNXNY-UHFFFAOYSA-N,"InChI=1S/C34H47NO8/c1-7-35-17-32(18-38-3)14-13-24(40-5)34-22-15-21-23(39-4)16-33(43-19(2)36,26(30(34)35)28(41-6)29(32)34)25(22)27(21)42-31(37)20-11-9-8-10-12-20/h8-12,21-30H,7,13-18H2,1-6H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(OC(C)=O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14,C34H47NO8,pos_2_2proton1ammonium,597.3301674639998,YVVFVJVAHWNXNY,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,3,7.5 7416,1718,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,CEWHOLPVDULJCE-LUJDFAQCSA-N,"InChI=1S/C34H47NO8/c1-7-35-17-32(18-38-3)14-13-24(40-5)34-22-15-21-23(39-4)16-33(25(22)27(21)42-19(2)36,26(30(34)35)28(41-6)29(32)34)43-31(37)20-11-9-8-10-12-20/h8-12,21-30H,7,13-18H2,1-6H3/t21-,22-,23+,24+,25-,26+,27+,28+,29-,30-,32+,33-,34+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](OC(=O)c5ccccc5)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C34H47NO8,pos_2_2proton1ammonium,597.330167464,CEWHOLPVDULJCE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 7417,1718,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,CEWHOLPVDULJCE-HPFWJHJXSA-N,"InChI=1S/C34H47NO8/c1-7-35-17-32(18-38-3)14-13-24(40-5)34-22-15-21-23(39-4)16-33(25(22)27(21)42-19(2)36,26(30(34)35)28(41-6)29(32)34)43-31(37)20-11-9-8-10-12-20/h8-12,21-30H,7,13-18H2,1-6H3/t21-,22-,23+,24+,25-,26+,27+,28+,29-,30?,32+,33-,34+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(OC(=O)c2ccccc2)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC(C)=O,C34H47NO8,pos_2_2proton1ammonium,597.330167464,CEWHOLPVDULJCE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,7.5 7418,1718,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,WNJQRAJXNHTDHD-GSWXQDNXSA-N,"InChI=1S/C34H47NO8/c1-8-35-18-31(3)15-14-24(39-5)33-22-16-21-23(38-4)17-32(40-6,25(22)26(21)43-29(37)20-12-10-9-11-13-20)34(41-7,30(33)35)28(27(31)33)42-19(2)36/h9-13,21-28,30H,8,14-18H2,1-7H3/t21-,22-,23+,24+,25-,26+,27-,28-,30+,31+,32-,33+,34-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)c7ccccc7)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@](OC)([C@H](OC(C)=O)[C@H]23)[C@@H]14,C34H47NO8,pos_2_2proton1ammonium,597.330167464,WNJQRAJXNHTDHD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,3,7.5 7419,1718,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,PEZDGSUPQGGPDV-JVPSRKDZSA-N,"InChI=1S/C34H47NO8/c1-6-35-17-32(18-39-2)23(36)15-24(41-4)34-21-14-20-22(40-3)16-33(38,27(31(34)35)29(42-5)30(32)34)26(21)28(20)43-25(37)13-12-19-10-8-7-9-11-19/h7-13,20-24,26-31,36,38H,6,14-18H2,1-5H3/b13-12+/t20-,21-,22+,23-,24+,26-,27+,28+,29+,30-,31-,32+,33-,34+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)/C=C/c7ccccc7)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C34H47NO8,pos_2_2proton1ammonium,597.3301674639998,PEZDGSUPQGGPDV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 7420,1718,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,OLGZCXJLBHNVSV-DDQVRILVSA-N,"InChI=1S/C32H47NO8/c1-7-33-15-29(16-37-2)20(34)13-21(39-4)32-18-14-30(35)11-12-31(36,24(28(32)33)26(41-6)27(29)32)23(18)22(30)17-9-8-10-19(38-3)25(17)40-5/h8-10,18,20-24,26-28,34-36H,7,11-16H2,1-6H3/t18-,20-,21+,22-,23-,24+,26+,27-,28-,29+,30-,31-,32+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)CC[C@@](O)([C@H]5[C@H]6c5cccc(OC)c5OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C32H47NO8,pos_2_2proton1acetonitrile,573.3301674639998,OLGZCXJLBHNVSV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,3,7.5 7421,1718,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.0,MS1_match,OLGZCXJLBHNVSV-DDQVRILVSA-N,"InChI=1S/C32H47NO8/c1-7-33-15-29(16-37-2)20(34)13-21(39-4)32-18-14-30(35)11-12-31(36,24(28(32)33)26(41-6)27(29)32)23(18)22(30)17-9-8-10-19(38-3)25(17)40-5/h8-10,18,20-24,26-28,34-36H,7,11-16H2,1-6H3/t18-,20-,21+,22-,23-,24+,26+,27-,28-,29+,30-,31-,32+/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)CC[C@@](O)([C@H]5[C@H]6c5cccc(OC)c5OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C32H47NO8,pos_2_2proton1acetonitrile,573.3301674639998,OLGZCXJLBHNVSV,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 7422,1714,-1,,,,0.0,MS1_match,AKWQMPYEQMQPBY-JWZDBOPLSA-N,"InChI=1S/C20H28O9/c1-16(2,25)18(26)12(21)13(22)20(27)17(3)5-4-8-9(7-28-14(8)23)10(17)6-11-19(20,29-11)15(18)24/h10-13,15,21-22,24-27H,4-7H2,1-3H3/t10-,11-,12+,13+,15+,17-,18-,19+,20+/m0/s1",CC(C)(O)[C@]1(O)[C@H](O)[C@@H](O)[C@]2(O)[C@]3(O[C@H]3C[C@H]3C4=C(CC[C@@]32C)C(=O)OC4)[C@@H]1O,C20H28O9,pos_1_minus1proton2sodium,412.173332476,AKWQMPYEQMQPBY,Terpenoids,Sesquiterpenoids,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 7423,1712,309,Polyketides,Aromatic polyketides,Catechols with side chains,0.33851403,ISDB,BENPXLIQKFYNHW-UHFFFAOYSA-N,"InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)20-24-21-26(29)23-27(30)22-24/h21-23,29-30H,2-20H2,1H3",CCCCCCCCCCCCCCCCCCCC(=O)Cc1cc(O)cc(O)c1,C27H46O3,,418.344695332,BENPXLIQKFYNHW,Polyketides,Aromatic polyketides,Catechols with side chains,Triticum aestivum,31926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Triticum'],['Triticum aestivum'],4,3,6.854056119918823 7424,1712,309,Polyketides,Aromatic polyketides,Catechols with side chains,0.33851403,ISDB,BENPXLIQKFYNHW-UHFFFAOYSA-N,"InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)20-24-21-26(29)23-27(30)22-24/h21-23,29-30H,2-20H2,1H3",CCCCCCCCCCCCCCCCCCCC(=O)Cc1cc(O)cc(O)c1,C27H46O3,,418.344695332,BENPXLIQKFYNHW,Polyketides,Aromatic polyketides,Catechols with side chains,Secale cereale,553015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Secale'],['Secale cereale'],4,3,6.854056119918823 7425,1710,33,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.76916146,ISDB,UOLUQSRSSLEMQA-POFXHGHASA-N,"InChI=1S/C22H36O3/c1-4-24-18-19(2)9-5-10-22(14-25-18)16(19)8-11-21-12-15(6-7-17(21)22)20(3,23)13-21/h15-18,23H,4-14H2,1-3H3/t15-,16-,17-,18+,19-,20-,21+,22+/m1/s1",CCO[C@H]1OC[C@@]23CCC[C@]1(C)[C@H]2CC[C@@]12C[C@@H](CC[C@H]13)[C@](C)(O)C2,C22H36O3,,348.266445012,UOLUQSRSSLEMQA,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,10.576645851135254 7426,1709,-1,,,,0.3159405,ISDB,,,,,,,OTQWGNRJCSNJLH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2637619972229004 7427,1707,-1,,,,0.6746076,ISDB,HPKXZPJOBRJOHF-ZHACJKMWSA-N,"InChI=1S/C18H30O5/c1-2-14-15(17(21)12-16(14)20)11-10-13(19)8-6-4-3-5-7-9-18(22)23/h10-11,13-16,19-20H,2-9,12H2,1H3,(H,22,23)/b11-10+",CCC1C(O)CC(=O)C1/C=C/C(O)CCCCCCCC(=O)O,C18H30O5,,326.20932406,HPKXZPJOBRJOHF,Fatty acids,Octadecanoids,Phytoprostanes,Olea europaea,23729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Oleeae'],['Olea'],['Olea europaea'],4,0,6.698430299758911 7428,1707,-1,,,,0.6746076,ISDB,HPKXZPJOBRJOHF-ZHACJKMWSA-N,"InChI=1S/C18H30O5/c1-2-14-15(17(21)12-16(14)20)11-10-13(19)8-6-4-3-5-7-9-18(22)23/h10-11,13-16,19-20H,2-9,12H2,1H3,(H,22,23)/b11-10+",CCC1C(O)CC(=O)C1/C=C/C(O)CCCCCCCC(=O)O,C18H30O5,,326.20932406,HPKXZPJOBRJOHF,Fatty acids,Octadecanoids,Phytoprostanes,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,0,6.698430299758911 7429,1706,-1,,,,0.0,MS1_match,WEYUSPOGCLAOEC-NCKBJQSISA-N,"InChI=1S/C29H38O16/c1-12(30)19-22(41-15(4)33)25(44-18(7)36)28(11-40-14(3)32)24(43-17(6)35)21(37)20-23(42-16(5)34)29(28,27(19,9)38)45-26(20,8)10-39-13(2)31/h19-20,22-25,38H,10-11H2,1-9H3/t19-,20+,22-,23+,24+,25-,26-,27-,28+,29-/m0/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@]1(O[C@@]3(C)COC(C)=O)[C@@](C)(O)[C@@H](C(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O,C29H38O16,pos_1_1proton1acetonitrile,642.215985136,WEYUSPOGCLAOEC,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia chiapensis,6092929.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia chiapensis'],6,0,6.0 7430,1703,-1,,,,0.66873705,ISDB,LFBLHUGGKDXXJU-CGTCWAPVSA-N,"InChI=1S/C30H42O4/c1-17(2)15-20-22-19(5)9-13-26-14-10-21-25(6,7)11-8-12-27(21,33)16-28(22,26)24(32)30(20)29(34-30,18(3)4)23(26)31/h9,15,18,20-22,33H,8,10-14,16H2,1-7H3/t20-,21-,22+,26+,27-,28+,29-,30+/m0/s1",CC(C)=C[C@H]1[C@H]2C(C)=CC[C@]34CC[C@H]5C(C)(C)CCC[C@]5(O)C[C@]23C(=O)[C@]12O[C@@]2(C(C)C)C4=O,C30H42O4,,466.308309824,LFBLHUGGKDXXJU,Terpenoids,Diterpenoids,Abietane diterpenoids,Salvia abrotanoides,305923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia abrotanoides'],4,0,6.674948215484619 7431,1703,-1,,,,0.66873705,ISDB,LFBLHUGGKDXXJU-CGTCWAPVSA-N,"InChI=1S/C30H42O4/c1-17(2)15-20-22-19(5)9-13-26-14-10-21-25(6,7)11-8-12-27(21,33)16-28(22,26)24(32)30(20)29(34-30,18(3)4)23(26)31/h9,15,18,20-22,33H,8,10-14,16H2,1-7H3/t20-,21-,22+,26+,27-,28+,29-,30+/m0/s1",CC(C)=C[C@H]1[C@H]2C(C)=CC[C@]34CC[C@H]5C(C)(C)CCC[C@]5(O)C[C@]23C(=O)[C@]12O[C@@]2(C(C)C)C4=O,C30H42O4,,466.308309824,LFBLHUGGKDXXJU,Terpenoids,Diterpenoids,Abietane diterpenoids,Salvia bucharica,448587.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia bucharica'],4,0,6.674948215484619 7432,1701,-1,,,,0.0,MS1_match,GHVNFZFCNZKVNT-UHFFFAOYSA-N,"InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)",CCCCCCCCCC(=O)O,C10H20O2,pos_1_1sodium1acetonitrile,172.14632988,GHVNFZFCNZKVNT,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 7433,1701,-1,,,,0.0,MS1_match,GHVNFZFCNZKVNT-UHFFFAOYSA-N,"InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)",CCCCCCCCCC(=O)O,C10H20O2,pos_1_1sodium1acetonitrile,172.14632988,GHVNFZFCNZKVNT,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 7434,1700,315,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,JNWQKXUWZWKUAY-JQEGGOPCSA-N,"InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5+",C/C=C(\C)C(=O)OCC/C=C\CC,C11H18O2,pos_2MH,182.130679816,JNWQKXUWZWKUAY,Fatty acids,Fatty esters,Wax monoesters,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7435,1693,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.508618,ISDB,OFAYIAUICPXDBC-QPSCCSFWSA-N,"InChI=1S/C15H24O/c1-10(2)12-5-6-15(4)9-13(16)7-11(3)14(15)8-12/h12-14,16H,1,3,5-9H2,2,4H3/t12-,13+,14+,15+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](O)CC(=C)[C@@H]2C1,C15H24O,,220.182715388,OFAYIAUICPXDBC,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,9.534471988677979 7436,1692,-1,,,,0.63142586,ISDB,ATIPDCIQTUXABX-UWVGGRQHSA-N,"InChI=1S/C12H25N3O3/c1-8(2)7-10(12(17)18)15-11(16)9(14)5-3-4-6-13/h8-10H,3-7,13-14H2,1-2H3,(H,15,16)(H,17,18)/t9-,10-/m0/s1",CC(C)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)O,C12H25N3O3,,259.18959166,ATIPDCIQTUXABX,Amino acids and Peptides,Small peptides,Dipeptides,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,0,6.525703430175781 7437,1692,-1,,,,0.63142586,ISDB,ATIPDCIQTUXABX-UWVGGRQHSA-N,"InChI=1S/C12H25N3O3/c1-8(2)7-10(12(17)18)15-11(16)9(14)5-3-4-6-13/h8-10H,3-7,13-14H2,1-2H3,(H,15,16)(H,17,18)/t9-,10-/m0/s1",CC(C)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)O,C12H25N3O3,,259.18959166,ATIPDCIQTUXABX,Amino acids and Peptides,Small peptides,Dipeptides,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,0,6.525703430175781 7438,1681,-1,,,,0.26180148,ISDB,,,,,,,OFKABAMHUKOKMV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.047205924987793 7439,1680,69,Terpenoids,Sesquiterpenoids,Furans,0.22402363,ISDB,QNJUNTVTYKUFSX-WNGAPAKLSA-N,"InChI=1S/C23H26O3/c1-15(2)19-12-9-16(3)13-20(19)22-21(24)14-18(26-23(22)25)11-10-17-7-5-4-6-8-17/h4-8,10-11,13-15,19-20,24H,9,12H2,1-3H3/b11-10+/t19-,20+/m1/s1",CC1=C[C@H](c2c(O)cc(/C=C/c3ccccc3)oc2=O)[C@@H](C(C)C)CC1,C23H26O3,,350.188194692,QNJUNTVTYKUFSX,Shikimates and Phenylpropanoids,Styrylpyrones,Kavalactones and derivatives,Alpinia hainanensis,718420.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Alpinia'],['Alpinia hainanensis'],4,0,4.896094501018524 7440,1680,69,Terpenoids,Sesquiterpenoids,Furans,0.22402363,ISDB,QNJUNTVTYKUFSX-WNGAPAKLSA-N,"InChI=1S/C23H26O3/c1-15(2)19-12-9-16(3)13-20(19)22-21(24)14-18(26-23(22)25)11-10-17-7-5-4-6-8-17/h4-8,10-11,13-15,19-20,24H,9,12H2,1-3H3/b11-10+/t19-,20+/m1/s1",CC1=C[C@H](c2c(O)cc(/C=C/c3ccccc3)oc2=O)[C@@H](C(C)C)CC1,C23H26O3,,350.188194692,QNJUNTVTYKUFSX,Shikimates and Phenylpropanoids,Styrylpyrones,Kavalactones and derivatives,Alpinia katsumadai,6024866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Alpinia'],['Alpinia katsumadae'],4,0,4.896094501018524 7441,1678,-1,,,,0.0,MS1_match,KLQIXIQHWLZXBE-CWDKFGSUSA-N,"InChI=1S/C23H30O8/c1-6-14(4)8-20(26)30-18-9-17-16(10-27-15(5)24)11-28-22(21(17)23(18)12-29-23)31-19(25)7-13(2)3/h7,9,11,14,18,21-22H,6,8,10,12H2,1-5H3/t14-,18-,21+,22-,23+/m0/s1",CC[C@H](C)CC(=O)O[C@H]1C=C2C(COC(C)=O)=CO[C@@H](OC(=O)C=C(C)C)[C@@H]2[C@@]12CO2,C23H30O8,pos_2_2proton2acetonitrile,434.19406792,KLQIXIQHWLZXBE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 7442,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,3,7.5 7443,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,7.5 7444,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 7445,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 7446,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,3,7.5 7447,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 7448,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7449,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,3,7.5 7450,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,3,7.5 7451,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,3,7.5 7452,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,3,7.5 7453,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,3,7.5 7454,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,3,7.5 7455,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,3,7.5 7456,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 7457,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,3,7.5 7458,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,3,7.5 7459,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,3,7.5 7460,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7461,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,3,7.5 7462,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KQEOKUJOWVGWDX-QFOSDGOKSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17-,20-,21-,22+/m1/s1",CC(=O)OCC1=CO[C@H](OC(=O)CC(C)C)[C@H]2[C@@H]1C[C@@H](OC(=O)CC(C)C)[C@@]21CO1,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,KQEOKUJOWVGWDX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 7463,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,3,7.5 7464,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,3,7.5 7465,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,3,7.5 7466,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,3,7.5 7467,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,3,7.5 7468,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,3,7.5 7469,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 7470,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,3,7.5 7471,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,3,7.5 7472,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,3,7.5 7473,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,3,7.5 7474,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,3,7.5 7475,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 7476,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,3,7.5 7477,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,3,7.5 7478,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,3,7.5 7479,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,3,7.5 7480,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,GXDIBKDQQDPOBI-BHIFYINESA-N,"InChI=1S/C22H32O8/c1-6-27-12-22(26)17(23)9-16-15(10-28-18(24)7-13(2)3)11-29-21(20(16)22)30-19(25)8-14(4)5/h9,11,13-14,20-21,26H,6-8,10,12H2,1-5H3/t20-,21+,22-/m1/s1",CCOC[C@@]1(O)C(=O)C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]21,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,GXDIBKDQQDPOBI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 7481,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,3,7.5 7482,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PVKOJQHHDYMUEI-RCUFNAHASA-N,"InChI=1S/C22H32O8/c1-12(2)6-15(24)9-26-17-10-27-21(30-19(25)7-13(3)4)20-16(17)8-18(29-14(5)23)22(20)11-28-22/h10,12-13,16,18,20-21H,6-9,11H2,1-5H3/t16-,18+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(OCC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PVKOJQHHDYMUEI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7483,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,3,7.5 7484,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,3,7.5 7485,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,3,7.5 7486,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,3,7.5 7487,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,3,7.5 7488,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,3,7.5 7489,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,3,7.5 7490,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,3,7.5 7491,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7492,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,3,7.5 7493,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7494,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,3,7.5 7495,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,3,7.5 7496,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,3,7.5 7497,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-KQUCSHIGSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17?,20+,21?,22+/m0/s1",CC(=O)OC1C[C@H]2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.209717984,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 7498,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,3,7.5 7499,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,3,7.5 7500,1677,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PHHROXLDZHUIGO-PNBTUHDLSA-N,"InChI=1S/C22H32O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h10,12-13,16-17,20-21H,6-9,11H2,1-5H3/t16-,17+,20-,21+,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O8,pos_1_1proton2acetonitrile,424.2097179839999,PHHROXLDZHUIGO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,3,7.5 7501,1675,-1,,,,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_1_1proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 7502,1675,-1,,,,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_1_1proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis recta,972679.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis recta'],8,0,8.0 7503,1675,-1,,,,0.0,MS1_match,YLRXAIKMLINXQY-ZDUSSCGKSA-O,"InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1",COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3,C20H24NO4+,pos_1_1proton1ammonium,342.1699846680899,YLRXAIKMLINXQY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,0,8.0 7504,1673,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.59915066,ISDB,JCJMEMDHUZYVMB-OAAMNHTFSA-N,"InChI=1S/C19H34O3/c1-3-4-5-6-8-11-14-17-18(22-17)15-12-9-7-10-13-16-19(20)21-2/h8,11,17-18H,3-7,9-10,12-16H2,1-2H3/b11-8-/t17-,18+/m1/s1",CCCCC/C=C\C[C@H]1O[C@H]1CCCCCCCC(=O)OC,C19H34O3,,310.250794948,JCJMEMDHUZYVMB,Fatty acids,Fatty Acids and Conjugates,Epoxy fatty acids,Aster alpinus,264974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Aster'],['Aster alpinus'],4,2,7.396602630615234 7505,1672,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,TYPSVDGIQAOBAD-DZGCQCFKSA-N,"InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1",C=C1CCC[C@]2(C)Cc3occ(C)c3C[C@@H]12,C15H20O,pos_2MH,216.15141526,TYPSVDGIQAOBAD,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 7506,1672,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,TYPSVDGIQAOBAD-DZGCQCFKSA-N,"InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1",C=C1CCC[C@]2(C)Cc3occ(C)c3C[C@@H]12,C15H20O,pos_2MH,216.15141526,TYPSVDGIQAOBAD,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,1,6.5 7507,1670,-1,,,,0.3836566,ISDB,,,,,,,FHFVOPNRJSTEAZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5346263647079468 7508,1669,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.77914685,ISDB,,,,,,,ZLYIWYCHNAZAQI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.1165874004364014 7509,1667,669,Shikimates and Phenylpropanoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CRZQGDNQQAALAY-UHFFFAOYSA-N,"InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3",COC(=O)Cc1ccccc1,C9H10O2,pos_1_1proton1methanol,150.06807956,CRZQGDNQQAALAY,Shikimates and Phenylpropanoids,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,1,8.5 7510,1661,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MWOOGOJBHIARFG-UHFFFAOYSA-N,"InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3",COc1cc(C=O)ccc1O,C8H8O3,pos_1_1proton,152.047344116,MWOOGOJBHIARFG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 7511,1660,18,Terpenoids,Diterpenoids,Halimane diterpenoids,0.21084827,ISDB,,,,,,,UFVAZSWBZSLTFV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.843393087387085 7512,1658,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1proton1acetonitrile,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 7513,1658,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1proton1acetonitrile,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 7514,1656,304,Terpenoids,Steroids,Ecdysteroids,0.0,MS1_match,APFXLSITBUTSAO-DYGWSSCLSA-N,"InChI=1S/C33H54O12/c1-29(2,41)9-8-24(37)32(5,42)23-7-11-33(43)17-12-19(35)18-13-21(44-28-27(40)26(39)25(38)22(15-34)45-28)20(36)14-30(18,3)16(17)6-10-31(23,33)4/h12,16,18,20-28,34,36-43H,6-11,13-15H2,1-5H3/t16-,18-,20-,21+,22+,23-,24+,25+,26-,27+,28+,30+,31+,32+,33+/m0/s1",CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C33H54O12,pos_2_2proton2acetonitrile,642.361527168,APFXLSITBUTSAO,Terpenoids,Steroids,Ecdysteroids,Helleborus multifidus,648056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus multifidus'],6,3,7.5 7515,1656,304,Terpenoids,Steroids,Ecdysteroids,0.0,MS1_match,APFXLSITBUTSAO-DYGWSSCLSA-N,"InChI=1S/C33H54O12/c1-29(2,41)9-8-24(37)32(5,42)23-7-11-33(43)17-12-19(35)18-13-21(44-28-27(40)26(39)25(38)22(15-34)45-28)20(36)14-30(18,3)16(17)6-10-31(23,33)4/h12,16,18,20-28,34,36-43H,6-11,13-15H2,1-5H3/t16-,18-,20-,21+,22+,23-,24+,25+,26-,27+,28+,30+,31+,32+,33+/m0/s1",CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C33H54O12,pos_2_2proton2acetonitrile,642.361527168,APFXLSITBUTSAO,Terpenoids,Steroids,Ecdysteroids,Helleborus torquatus,948051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus torquatus'],6,3,7.5 7516,1653,-1,,,,0.0,MS1_match,QMQFACNPAACIRS-UHFFFAOYSA-N,"InChI=1S/C28H36O6/c1-17(29)21-11-14-28(33)26(21,3)23(34-24(31)18-7-5-4-6-8-18)16-22-25(2)12-10-20(30)15-19(25)9-13-27(22,28)32/h4-8,15,19,21-23,30,32-33H,9-14,16H2,1-3H3",CC(=O)C1CCC2(O)C3(O)CCC4C=C(O)CCC4(C)C3CC(OC(=O)c3ccccc3)C12C,C28H36O6,pos_1_1proton1ethylamine,468.251188872,QMQFACNPAACIRS,Terpenoids,Steroids,Pregnane steroids,Adonis amurensis,243850.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis amurensis'],6,0,6.0 7517,1649,150,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.22396731,ISDB,IBGZNOPZUVZSEJ-XSVWGIRKSA-N,"InChI=1S/C20H27NO11/c22-6-11-13(23)15(25)17(27)19(31-11)29-7-12-14(24)16(26)18(28)20(32-12)30-10-5-21-9-4-2-1-3-8(9)10/h1-5,11-28H,6-7H2/t11-,12-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1",OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c[nH]c4ccccc34)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C20H27NO11,,457.158410684,IBGZNOPZUVZSEJ,,,,Calanthe discolor,809338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Collabieae'],['Calanthe'],['Calanthe discolor'],4,0,4.895869255065918 7518,1646,557,Alkaloids,Pseudoalkaloids,Cyanogenic glycosides,0.0,MS1_match,MNQMVPGTCARFMJ-RXRFSQMPSA-N,"InChI=1S/C31H42N2O2/c1-27-6-3-7-30-23(27)5-9-29-18-21(17-28-8-4-22(34)16-26(28)32(2)11-10-28)20(14-24(29)30)15-25(29)31(30)33(19-27)12-13-35-31/h4,8,18,20,23-26H,3,5-7,9-17,19H2,1-2H3/t20-,23-,24-,25+,26+,27+,28+,29+,30+,31-/m1/s1",CN1CC[C@]2(CC3=C[C@@]45CC[C@@H]6[C@@]7(C)CCC[C@@]68[C@@H]4C[C@@H]3C[C@@H]5[C@@]83OCCN3C7)C=CC(=O)C[C@H]12,C31H42N2O2,pos_1_1proton1dmso,474.324628584,MNQMVPGTCARFMJ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum coreanum,377294.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum coreanum'],6,2,7.0 7519,1644,-1,,,,0.0,MS1_match,VQSGSHVNMAGNDE-UHFFFAOYSA-N,"InChI=1S/C12H12O3/c1-2-14-6-10-7-15-8-12-9(5-13)3-4-11(10)12/h3-5,7-8H,2,6H2,1H3",CCOCc1cocc2c(C=O)ccc1-2,C12H12O3,pos_1_1proton1isopropanol,204.078644244,VQSGSHVNMAGNDE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 7520,1644,-1,,,,0.0,MS1_match,VQSGSHVNMAGNDE-UHFFFAOYSA-N,"InChI=1S/C12H12O3/c1-2-14-6-10-7-15-8-12-9(5-13)3-4-11(10)12/h3-5,7-8H,2,6H2,1H3",CCOCc1cocc2c(C=O)ccc1-2,C12H12O3,pos_1_1proton1isopropanol,204.078644244,VQSGSHVNMAGNDE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,0,6.0 7521,1640,-1,,,,0.41661578,ISDB,,,,,,,HNLWVJBFVNDZQJ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6664631366729736 7522,1636,-1,,,,0.0,MS1_match,PTANMXMDKJWUPQ-GUXIHRGDSA-N,"InChI=1S/C26H43NO8/c1-7-27-12-22(13-31-2)9-8-16(33-4)25-19(22)20(35-6)26(30,21(25)27)24(29)11-15(32-3)14-10-23(25,28)18(24)17(14)34-5/h14-21,28-30H,7-13H2,1-6H3/t14-,15+,16+,17+,18+,19-,20+,21+,22+,23+,24-,25-,26-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC,C26H43NO8,pos_1_1proton1methanol,497.298867336,PTANMXMDKJWUPQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium,518366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Unknown'],6,0,6.0 7523,1633,-1,,,,0.31152308,ISDB,XEJKMPUDEZRWRD-ARQDATDDSA-N,"InChI=1S/C22H28O2/c1-2-3-4-5-6-7-8-9-10-11-17(21(23)24)22-13-12-15-18(22)14-16-19(15)20(16)22/h3-8,12-13,15-20H,2,9-11,14H2,1H3,(H,23,24)/b4-3+,6-5+,8-7+",CC/C=C/C=C/C=C/CCCC(C(=O)O)C12C=CC3C4C(CC31)C42,C22H28O2,,324.208930136,XEJKMPUDEZRWRD,Polyketides,,,Prunus persica,259054.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus persica'],0,0,1.2460923194885254 7524,1633,-1,,,,0.31152308,ISDB,XEJKMPUDEZRWRD-RBLSWJEHSA-N,"InChI=1S/C22H28O2/c1-2-3-4-5-6-7-8-9-10-11-17(21(23)24)22-13-12-15-18(22)14-16-19(15)20(16)22/h3-8,12-13,15-20H,2,9-11,14H2,1H3,(H,23,24)/b4-3+,6-5+,8-7+/t15-,16+,17+,18-,19-,20+,22-/m0/s1",CC/C=C/C=C/C=C/CCC[C@H](C(=O)O)[C@@]12C=C[C@@H]3[C@H]4[C@@H](C[C@@H]31)[C@H]42,C22H28O2,,324.208930136,XEJKMPUDEZRWRD,Polyketides,,,Cryptocarya amygdalina,6025881.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Cryptocarya'],['Cryptocarya amygdalina'],0,0,1.2460923194885254 7525,1630,294,Polyketides,Cyclic polyketides,Cinnamic acids and derivatives,0.3570563,ISDB,VJZWZDQDXPADSE-NSHDSACASA-N,"InChI=1S/C11H18O3/c1-4-5-6-7-11(13)9(3)8(2)10(12)14-11/h13H,4-7H2,1-3H3/t11-/m0/s1",CCCCC[C@]1(O)OC(=O)C(C)=C1C,C11H18O3,,198.125594436,VJZWZDQDXPADSE,Polyketides,,,Rhaphidophora decursiva,474105.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Alismatales'],['Araceae'],['Monstereae'],['Rhaphidophora'],['Rhaphidophora decursiva'],4,1,5.928225159645081 7526,1630,294,Polyketides,Cyclic polyketides,Cinnamic acids and derivatives,0.3570563,ISDB,VJZWZDQDXPADSE-NSHDSACASA-N,"InChI=1S/C11H18O3/c1-4-5-6-7-11(13)9(3)8(2)10(12)14-11/h13H,4-7H2,1-3H3/t11-/m0/s1",CCCCC[C@]1(O)OC(=O)C(C)=C1C,C11H18O3,,198.125594436,VJZWZDQDXPADSE,Polyketides,,,Litsea verticillata,1052065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Litsea'],['Litsea verticillata'],4,1,5.928225159645081 7527,1630,294,Polyketides,Cyclic polyketides,Cinnamic acids and derivatives,0.3570563,ISDB,VJZWZDQDXPADSE-NSHDSACASA-N,"InChI=1S/C11H18O3/c1-4-5-6-7-11(13)9(3)8(2)10(12)14-11/h13H,4-7H2,1-3H3/t11-/m0/s1",CCCCC[C@]1(O)OC(=O)C(C)=C1C,C11H18O3,,198.125594436,VJZWZDQDXPADSE,Polyketides,,,Vatica cinerea,6114958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Dipterocarpaceae'],['Unknown'],['Vatica'],['Vatica cinerea'],4,1,5.928225159645081 7528,1630,294,Polyketides,Cyclic polyketides,Cinnamic acids and derivatives,0.3570563,ISDB,VJZWZDQDXPADSE-UHFFFAOYSA-N,"InChI=1S/C11H18O3/c1-4-5-6-7-11(13)9(3)8(2)10(12)14-11/h13H,4-7H2,1-3H3",CCCCCC1(O)OC(=O)C(C)=C1C,C11H18O3,,198.125594436,VJZWZDQDXPADSE,Polyketides,,,Phleum pratense,578767.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Poeae'],['Phleum'],['Phleum pratense'],4,1,5.928225159645081 7529,1629,-1,,,,0.4374302,ISDB,,,,,,,UEUBGZRBSVKCEF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.749720811843872 7530,1627,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.2508231,ISDB,CCWBQLZOTVKFAJ-USNSYDTGSA-N,"InChI=1S/C17H29NO3/c1-13(8-4-3-7-11-19)12-14-16(20)17(2,21)15-9-5-6-10-18(14)15/h3-4,8,14-16,19-21H,5-7,9-12H2,1-2H3/b4-3+,13-8+/t14-,15+,16-,17-/m0/s1",C/C(=C\C=C\CCO)C[C@H]1[C@H](O)[C@@](C)(O)[C@H]2CCCCN12,C17H29NO3,,295.214743788,CCWBQLZOTVKFAJ,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,2,2.003292441368103 7531,1627,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.2508231,ISDB,CCWBQLZOTVKFAJ-UHFFFAOYSA-N,"InChI=1S/C17H29NO3/c1-13(8-4-3-7-11-19)12-14-16(20)17(2,21)15-9-5-6-10-18(14)15/h3-4,8,14-16,19-21H,5-7,9-12H2,1-2H3",CC(=CC=CCCO)CC1C(O)C(C)(O)C2CCCCN12,C17H29NO3,,295.214743788,CCWBQLZOTVKFAJ,Alkaloids,Lysine alkaloids,Indolizidine alkaloids,Streptomyces albidoflavus,772836.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Streptomyces albidoflavus'],0,2,2.003292441368103 7532,1626,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.77731615,ISDB,BXBVPYSHEOQGHP-UHFFFAOYSA-N,"InChI=1S/C17H26O4/c1-13(2)7-5-4-6-8-17(19)21-12-14-9-10-15(18)16(11-14)20-3/h9-11,13,18H,4-8,12H2,1-3H3",COc1cc(COC(=O)CCCCCC(C)C)ccc1O,C17H26O4,,294.183109312,BXBVPYSHEOQGHP,Alkaloids,Pseudoalkaloids,Capsaicins and Capsaicinoids,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,0,7.109264612197876 7533,1625,4,Alkaloids,Lysine alkaloids,Terpenoid alkaloids,0.2409057,ISDB,YVWVILBCUPRAIC-LKFDHHINSA-N,"InChI=1S/C16H27NO2/c1-2-3-4-5-6-7-8-9-10-14-11-12-16(19)15(13-18)17-14/h5-10,14-19H,2-4,11-13H2,1H3/b6-5+,8-7+,10-9+/t14-,15-,16-/m1/s1",CCCC/C=C/C=C/C=C/[C@@H]1CC[C@@H](O)[C@@H](CO)N1,C16H27NO2,,265.204179104,YVWVILBCUPRAIC,Alkaloids,Lysine alkaloids,Piperidine alkaloids,Microcos philippinensis,6116647.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Grewieae'],['Microcos'],['Microcos philippinensis'],4,2,5.963622808456421 7534,1622,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.4936814,ISDB,KFTJQBMBWGAXNI-HCLFTBTMSA-N,"InChI=1S/C27H34O2/c1-24(2)21-11-13-27-12-10-20(26(4,29)17-27)15-22(27)25(21,3)16-19(23(24)28)14-18-8-6-5-7-9-18/h5-10,12,14,20-22,29H,11,13,15-17H2,1-4H3/b19-14+/t20-,21+,22-,25+,26-,27+/m0/s1",CC1(C)C(=O)/C(=C/c2ccccc2)C[C@]2(C)[C@@H]1CC[C@@]13C=C[C@@H](C[C@H]12)[C@@](C)(O)C3,C27H34O2,,390.255880328,KFTJQBMBWGAXNI,Terpenoids,Diterpenoids,Atisane diterpenoids,Androstachys johnsonii,510615.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Picrodendraceae'],['Unknown'],['Androstachys'],['Androstachys johnsonii'],0,1,2.474725604057312 7535,1619,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1potassium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 7536,1619,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1potassium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 7537,1619,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1potassium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 7538,1619,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_1potassium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 7539,1618,-1,,,,0.0,MS1_match,KTFFOTYEMQOLKB-HQRXZHMLSA-N,"InChI=1S/C31H36O14/c1-16(32)40-15-30-21(43-26(35)19-8-11-38-13-19)7-10-29(6,37)31(30)24(42-18(3)34)22(28(4,5)45-31)23(41-17(2)33)25(30)44-27(36)20-9-12-39-14-20/h8-9,11-14,21-25,37H,7,10,15H2,1-6H3/t21-,22+,23+,24+,25+,29-,30-,31-/m0/s1",CC(=O)OC[C@@]12[C@@H](OC(=O)c3ccoc3)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1ccoc1)[C@H]3OC(C)=O,C31H36O14,pos_2_1proton1sodium,632.2105058319999,KTFFOTYEMQOLKB,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 7540,1618,-1,,,,0.0,MS1_match,UIECACVRTPYSCK-MVPWXCBGSA-N,"InChI=1S/C31H36O14/c1-16(32)40-15-30-23(43-26(35)20-9-7-11-38-20)13-19-24(44-27(36)21-10-8-12-39-21)31(30,45-28(19,4)5)29(6,37)14-22(41-17(2)33)25(30)42-18(3)34/h7-12,19,22-25,37H,13-15H2,1-6H3/t19-,22+,23+,24-,25+,29+,30-,31+/m1/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccco3)C[C@@H]3[C@@H](OC(=O)c4ccco4)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](OC(C)=O)[C@@H]2OC(C)=O,C31H36O14,pos_2_1proton1sodium,632.210505832,UIECACVRTPYSCK,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Monteverdia cuzcoina,6092941.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia cuzcoina'],6,0,6.0 7541,1618,-1,,,,0.0,MS1_match,ODCAMDJMGUTWOU-UFAKWALKSA-N,"InChI=1S/C31H36O14/c1-16(32)40-15-30-21(41-17(2)33)7-10-29(6,37)31(30)25(42-18(3)34)23(28(4,5)45-31)22(27(36)43-20-9-12-39-14-20)24(30)44-26(35)19-8-11-38-13-19/h8-9,11-14,21-25,37H,7,10,15H2,1-6H3/t21-,22+,23-,24+,25-,29+,30-,31+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)CC[C@](C)(O)[C@]13OC(C)(C)[C@H]([C@H](C(=O)Oc1ccoc1)[C@@H]2OC(=O)c1ccoc1)[C@H]3OC(C)=O,C31H36O14,pos_2_1proton1sodium,632.210505832,ODCAMDJMGUTWOU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,0,6.0 7542,1616,-1,,,,0.49383485,ISDB,XZFXZUSMWRAOOU-MAUKXSAKSA-N,"InChI=1S/C19H20O6/c1-24-17-9-12(16(23)6-7-20)8-14-15(10-21)18(25-19(14)17)11-2-4-13(22)5-3-11/h2-5,8-9,15,18,20-22H,6-7,10H2,1H3/t15-,18+/m0/s1",COc1cc(C(=O)CCO)cc2c1O[C@H](c1ccc(O)cc1)[C@H]2CO,C19H20O6,,344.12598835999995,XZFXZUSMWRAOOU,Shikimates and Phenylpropanoids,Lignans,Neolignans,Broussonetia papyrifera,311274.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Broussonetia'],['Broussonetia papyrifera'],4,0,5.975339412689209 7543,1611,-1,,,,0.48334837,ISDB,,,,,,,IKYLOLYDHRFIOQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.9333934783935547 7544,1610,608,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,IUCHKMAZAWJNBJ-RCYXVVTDSA-N,"InChI=1S/C36H56O9/c1-31(2)14-16-36(30(42)43)17-15-34(6)19(20(36)18-31)8-9-22-33(5)12-11-23(32(3,4)21(33)10-13-35(22,34)7)44-29-26(39)24(37)25(38)27(45-29)28(40)41/h8,20-27,29,37-39H,9-18H2,1-7H3,(H,40,41)(H,42,43)/t20-,21-,22+,23-,24-,25-,26+,27-,29+,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O9,pos_1_1proton1isopropanol,632.392433372,IUCHKMAZAWJNBJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,3,8.5 7545,1607,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5590429,ISDB,JUSSIJFTWFUOLF-UHFFFAOYSA-N,"InChI=1S/C13H16O2/c1-8-4-5-12(14)11-6-9(2)13(15-3)7-10(8)11/h6-8H,4-5H2,1-3H3",COc1cc2c(cc1C)C(=O)CCC2C,C13H16O2,,204.115029752,JUSSIJFTWFUOLF,Terpenoids,,,Aristolochia constricta,6028729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Aristolochiaceae'],['Unknown'],['Aristolochia'],['Aristolochia constricta'],4,1,6.73617148399353 7546,1606,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.611186,ISDB,HRALRUDVSKRSQK-UHFFFAOYSA-N,"InChI=1S/C19H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h2H,1,3-14,17-18H2,(H,20,21)",C=CCCCCCCCCCCCCC#CCCC(=O)O,C19H32O2,,292.240230264,HRALRUDVSKRSQK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Hymenodictyon orixense,47116.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Hymenodictyeae'],['Hymenodictyon'],['Hymenodictyon orixense'],4,3,7.944744110107422 7547,1606,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.611186,ISDB,HRALRUDVSKRSQK-UHFFFAOYSA-N,"InChI=1S/C19H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h2H,1,3-14,17-18H2,(H,20,21)",C=CCCCCCCCCCCCCC#CCCC(=O)O,C19H32O2,,292.240230264,HRALRUDVSKRSQK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Hymenodictyon excelsum,535691.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Hymenodictyeae'],['Hymenodictyon'],['Hymenodictyon excelsum'],4,3,7.944744110107422 7548,1605,-1,,,,0.22486156,ISDB,,,,,,,PPVRJCXEIBRCDT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8994462490081787 7549,1604,-1,,,,0.0,MS1_match,TZZAKSLHHIJRLL-UHFFFAOYSA-N,"InChI=1S/C8H9NO3/c1-12-7-4-5(8(9)11)2-3-6(7)10/h2-4,10H,1H3,(H2,9,11)",COc1cc(C(N)=O)ccc1O,C8H9NO3,pos_2MH,167.058243148,TZZAKSLHHIJRLL,Alkaloids,Peptide alkaloids,Simple amide alkaloids,Naravelia zeylanica,274607.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Naravelia'],['Naravelia zeylanica'],7,0,7.0 7550,1597,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton1ammonium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7551,1597,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton1ammonium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7552,1595,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,CJPNOLIZCWDHJK-UHFFFAOYSA-N,"InChI=1S/C15H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(2)16/h3-14H2,1-2H3",CCCCCCCCCCCCCC(C)=O,C15H30O,pos_1_1proton1ammonium,226.22966558,CJPNOLIZCWDHJK,Fatty acids,Fatty acyls,Oxygenated hydrocarbons,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7553,1588,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.24259533,ISDB,,,,,,,IGTDRTJURKLVPF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9703813195228577 7554,1584,-1,,,,0.6872113,ISDB,RPVXENZJFAXSJY-GOEBONIOSA-N,"InChI=1S/C16H24O/c1-15(2)7-4-8-16(3)10-11-5-6-13(17)12(11)9-14(15)16/h14H,4-10H2,1-3H3/t14-,16+/m0/s1",CC1(C)CCC[C@]2(C)CC3=C(C[C@@H]12)C(=O)CC3,C16H24O,,232.182715388,RPVXENZJFAXSJY,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,Wurfbainia villosa,477379.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Wurfbainia'],['Wurfbainia villosa'],4,0,6.748845100402832 7555,1583,-1,,,,0.0,MS1_match,IBFPFYPZOPHYKC-RVSDKLHUSA-N,"InChI=1S/C29H44O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h19-22,30H,7-16H2,1-6H3,(H,32,33)/t19-,20+,21+,22-,25-,26-,27+,28-,29+/m1/s1",CC1=C2CC[C@H]3[C@@](C)(CC[C@@]4(C)[C@@H]5C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@]34C)[C@@H]2C[C@H](O)C1=O,C29H44O4,pos_1_1proton1ammonium,456.323959888,IBFPFYPZOPHYKC,Terpenoids,Triterpenoids,Friedelane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 7556,1583,-1,,,,0.0,MS1_match,RDOIACMZJPLQIZ-UHFFFAOYSA-N,"InChI=1S/C29H44O4/c1-16-9-12-29(25(32)33)14-13-27(5)20(23(29)17(16)2)7-8-22-26(4)15-21(30)24(31)18(3)19(26)10-11-28(22,27)6/h7,16-17,19,21-24,30-31H,3,8-15H2,1-2,4-6H3,(H,32,33)",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C)C(C)CCC3(C(=O)O)CCC21C,C29H44O4,pos_1_1proton1ammonium,456.323959888,RDOIACMZJPLQIZ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 7557,1583,-1,,,,0.0,MS1_match,RDOIACMZJPLQIZ-UHFFFAOYSA-N,"InChI=1S/C29H44O4/c1-16-9-12-29(25(32)33)14-13-27(5)20(23(29)17(16)2)7-8-22-26(4)15-21(30)24(31)18(3)19(26)10-11-28(22,27)6/h7,16-17,19,21-24,30-31H,3,8-15H2,1-2,4-6H3,(H,32,33)",C=C1C(O)C(O)CC2(C)C1CCC1(C)C2CC=C2C3C(C)C(C)CCC3(C(=O)O)CCC21C,C29H44O4,pos_1_1proton1ammonium,456.323959888,RDOIACMZJPLQIZ,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Weigela subsessilis,82213.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Weigela'],['Weigela subsessilis'],6,0,6.0 7558,1583,-1,,,,0.0,MS1_match,QYVZEPLDLPYECM-UHFFFAOYSA-N,"InChI=1S/C27H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-31-27(30)21-19-24-18-20-25(28)26(29)23-24/h18-21,23,28-29H,2-17,22H2,1H3",CCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(O)c1,C27H44O4,pos_1_1proton1acetonitrile,432.32395988799993,QYVZEPLDLPYECM,Shikimates and Phenylpropanoids,,,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,0,6.0 7559,1582,1150,Alkaloids,Pseudoalkaloids,Atisane diterpenoids,0.0,MS1_match,MGEDPNBPAMLIHW-WVRIYPJASA-N,"InChI=1S/C21H27NO2/c1-11-7-19-8-20(24)10-22-9-18(2)4-3-5-21(17(18)20)15(19)14(23)12(11)6-13(19)16(21)22/h12-13,15-17,24H,1,3-10H2,2H3/t12-,13-,15-,16-,17+,18+,19+,20+,21+/m1/s1",C=C1C[C@@]23C[C@]4(O)CN5C[C@]6(C)CCC[C@@]7([C@@H]2C(=O)[C@@H]1C[C@@H]3[C@@H]57)[C@@H]64,C21H27NO2,pos_1_1proton2acetonitrile,325.204179104,MGEDPNBPAMLIHW,Terpenoids,Diterpenoids,Atisane diterpenoids,Thalictrum javanicum,124737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum javanicum'],6,3,7.5 7560,1582,1150,Alkaloids,Pseudoalkaloids,Atisane diterpenoids,0.0,MS1_match,MGEDPNBPAMLIHW-UHFFFAOYSA-N,"InChI=1S/C21H27NO2/c1-11-7-19-8-20(24)10-22-9-18(2)4-3-5-21(17(18)20)15(19)14(23)12(11)6-13(19)16(21)22/h12-13,15-17,24H,1,3-10H2,2H3",C=C1CC23CC4(O)CN5CC6(C)CCCC7(C5C2CC1C(=O)C37)C64,C21H27NO2,pos_1_1proton2acetonitrile,325.204179104,MGEDPNBPAMLIHW,Terpenoids,Diterpenoids,Atisane diterpenoids,Thalictrum sessile,124737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum javanicum'],6,3,7.5 7561,1576,-1,,,,0.2864837,ISDB,OQWQQASPTCXQLO-LMMKCTJWSA-N,"InChI=1S/C19H26O3/c1-18(2)16-6-5-12-9-13(11-20)15(22-4)10-14(12)19(16,3)8-7-17(18)21/h5-6,9-10,16-17,20-21H,7-8,11H2,1-4H3/t16-,17-,19+/m1/s1",COc1cc2c(cc1CO)C=C[C@@H]1C(C)(C)[C@H](O)CC[C@@]21C,C19H26O3,,302.188194692,OQWQQASPTCXQLO,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Flueggea virosa,351505.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Flueggea'],['Flueggea virosa'],4,0,5.145934820175171 7562,1575,1555,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JAKRMJRMMPOUJX-PFRKTALLSA-N,"InChI=1S/C28H45NO7/c1-8-29-13-25(4)10-9-18(34-6)27-16-11-15-17(33-5)12-26(31,19(16)20(15)36-23(30)14(2)3)28(32,24(27)29)22(35-7)21(25)27/h14-22,24,31-32H,8-13H2,1-7H3/t15-,16-,17+,18+,19-,20+,21-,22+,24+,25+,26-,27+,28-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)C(C)C)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C28H45NO7,pos_1_1proton,507.3196027799999,JAKRMJRMMPOUJX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium halteratum,209854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium halteratum'],6,3,7.5 7563,1575,1555,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JAKRMJRMMPOUJX-PFRKTALLSA-N,"InChI=1S/C28H45NO7/c1-8-29-13-25(4)10-9-18(34-6)27-16-11-15-17(33-5)12-26(31,19(16)20(15)36-23(30)14(2)3)28(32,24(27)29)22(35-7)21(25)27/h14-22,24,31-32H,8-13H2,1-7H3/t15-,16-,17+,18+,19-,20+,21-,22+,24+,25+,26-,27+,28-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC(=O)C(C)C)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C28H45NO7,pos_1_1proton,507.3196027799999,JAKRMJRMMPOUJX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,3,7.5 7564,1572,-1,,,,0.0,MS1_match,KMNWXNMZIFUOKX-HYOIWIKGSA-N,"InChI=1S/C25H31N2O7/c1-14-11-17-20(18(12-14)32-2)21(27-10-4-3-9-26(17)27)15-5-7-16(8-6-15)33-25-24(31)23(30)22(29)19(13-28)34-25/h5-8,11-12,19,22-25,28-31H,3-4,9-10,13H2,1-2H3/q+1/t19-,22-,23+,24-,25-/m1/s1",COc1cc(C)cc2c1C(=C1C=CC(=[O+][C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C1)N1CCCCN21,C25H31N2O7+,pos_1_1proton,471.21257775209,KMNWXNMZIFUOKX,Alkaloids,,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 7565,1568,-1,,,,0.40745735,ISDB,PHOPGVYKZWPIGA-UHFFFAOYSA-N,"InChI=1S/C11H16O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h6-7,12-13H,3-5H2,1-2H3",COc1cc(CCCO)cc(OC)c1O,C11H16O4,,212.104858992,PHOPGVYKZWPIGA,,,,Tinospora smilacina,1051363.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Burasaieae'],['Tinospora'],['Tinospora smilacina'],5,0,6.629829406738281 7566,1565,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.28173319,ISDB,WQLFXXMSVDKBCS-UQKDKWODSA-N,"InChI=1S/C41H62O5/c1-27-11-21-34-38(3,23-9-25-40(34,5)36(43)45-7)31(27)18-15-29-13-16-30(17-14-29)33(42)20-19-32-28(2)12-22-35-39(32,4)24-10-26-41(35,6)37(44)46-8/h13,30-32,34-35H,1-2,9-12,14-26H2,3-8H3/t30-,31+,32+,34-,35-,38-,39-,40-,41-/m0/s1",C=C1CC[C@H]2[C@@](C)(CCC[C@]2(C)C(=O)OC)[C@@H]1CCC(=O)[C@H]1CC=C(CC[C@@H]2C(=C)CC[C@H]3[C@@]2(C)CCC[C@]3(C)C(=O)OC)CC1,C41H62O5,,634.459725084,WQLFXXMSVDKBCS,Terpenoids,Diterpenoids,Labdane diterpenoids,Xylopia aromatica,3867945.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Xylopieae'],['Xylopia'],['Xylopia aromatica'],4,0,5.126932740211487 7567,1563,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2proton2acetonitrile,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 7568,1563,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2proton2acetonitrile,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,1,6.5 7569,1563,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2proton2acetonitrile,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 7570,1563,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2proton2acetonitrile,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,1,6.5 7571,1563,252,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.0,MS1_match,MLWDGPFGTFOLRJ-CUVHLRMHSA-N,"InChI=1S/C28H32O14/c1-11-21(32)23(34)25(36)27(38-11)42-26-24(35)22(33)19(10-29)41-28(26)39-14-7-15(30)20-16(31)9-17(40-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-30,32-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2proton2acetonitrile,592.179205704,MLWDGPFGTFOLRJ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebourii,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,1,6.5 7572,1560,-1,,,,0.0,MS1_match,ICJMGMIQWBNSNM-QRCQAKELSA-N,"InChI=1S/C42H48N2O18/c1-19-20(2)36(50)60-33-31(57-23(5)47)35(61-37(51)26-12-10-14-43-16-26)41(18-54-21(3)45)34(59-25(7)49)30(56-22(4)46)28-32(58-24(6)48)42(41,40(33,9)53)62-39(28,8)17-55-38(52)27-13-11-15-44-29(19)27/h10-16,19-20,28,30-35,53H,17-18H2,1-9H3/t19-,20+,28-,30-,31+,32-,33+,34-,35+,39+,40+,41-,42+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(=O)c1cccnc1)[C@]4(C)O,C42H48N2O18,pos_2_2proton2acetonitrile,868.2902126960001,ICJMGMIQWBNSNM,,,,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,0,7.0 7573,1560,-1,,,,0.0,MS1_match,ICJMGMIQWBNSNM-QRCQAKELSA-N,"InChI=1S/C42H48N2O18/c1-19-20(2)36(50)60-33-31(57-23(5)47)35(61-37(51)26-12-10-14-43-16-26)41(18-54-21(3)45)34(59-25(7)49)30(56-22(4)46)28-32(58-24(6)48)42(41,40(33,9)53)62-39(28,8)17-55-38(52)27-13-11-15-44-29(19)27/h10-16,19-20,28,30-35,53H,17-18H2,1-9H3/t19-,20+,28-,30-,31+,32-,33+,34-,35+,39+,40+,41-,42+/m1/s1",CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(=O)c1cccnc1)[C@]4(C)O,C42H48N2O18,pos_2_2proton2acetonitrile,868.2902126960001,ICJMGMIQWBNSNM,,,,Euonymus japonicus,180140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus japonicus'],7,0,7.0 7574,1557,508,Terpenoids,Monoterpenoids,Pyranocoumarins,0.6777652,ISDB,HYRHDNDBYPEHPQ-JWCOTYKISA-N,"InChI=1S/C16H21NO4/c1-11(18)3-8-15-14(9-16(19)21-15)17-13-6-4-12(5-7-13)10-20-2/h3-8,11,14-15,17-18H,9-10H2,1-2H3/b8-3+/t11-,14-,15+/m0/s1",COCc1ccc(N[C@H]2CC(=O)O[C@@H]2/C=C/[C@H](C)O)cc1,C16H21NO4,,291.147058152,HYRHDNDBYPEHPQ,,,,Streptomyces viridochromogenes,676476.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Streptomyces viridochromogenes'],0,0,2.7110607624053955 7575,1556,-1,,,,0.67057306,ISDB,XLHIYUYCSMZCCC-VMPITWQZSA-N,"InChI=1S/C15H14O4/c1-17-12-6-3-11(4-7-12)5-8-13-9-14(18-2)10-15(16)19-13/h3-10H,1-2H3/b8-5+",COc1ccc(/C=C/c2cc(OC)cc(=O)o2)cc1,C15H14O4,,258.089208928,XLHIYUYCSMZCCC,Shikimates and Phenylpropanoids,Styrylpyrones,Kavalactones and derivatives,Ranunculus silerifolius,22674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus silerifolius'],6,0,8.682292222976685 7576,1553,82,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7577,1553,82,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 7578,1553,82,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7579,1553,82,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 7580,1553,82,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,3,7.5 7581,1553,82,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7582,1549,-1,,,,0.0,MS1_match,FVWJYYTZTCVBKE-ROUWMTJPSA-N,"InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1",C=C(C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H50O2,pos_1_1proton1ammonium,442.38108084,FVWJYYTZTCVBKE,Terpenoids,Triterpenoids,Lupane triterpenoids,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 7583,1549,-1,,,,0.0,MS1_match,FVWJYYTZTCVBKE-ROUWMTJPSA-N,"InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1",C=C(C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H50O2,pos_1_1proton1ammonium,442.38108084,FVWJYYTZTCVBKE,Terpenoids,Triterpenoids,Lupane triterpenoids,Valeriana laxiflora,844983.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana laxiflora'],6,0,6.0 7584,1548,382,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,WTTJVINHCBCLGX-UHFFFAOYSA-N,"InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11H,3-6,9,12-18H2,1-2H3",CCCCCC=CCC=CCCCCCCCC(=O)OC,C19H34O2,pos_1_1proton1acetonitrile,294.255880328,WTTJVINHCBCLGX,Fatty acids,Fatty esters,Wax monoesters,Caltha palustris,387810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Caltheae'],['Caltha'],['Caltha palustris'],6,3,7.5 7585,1547,-1,,,,0.32523912,ISDB,PBWRFXQNNGSAQG-UHFFFAOYSA-N,"InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3",C=C1C(OC(C)=O)CC2(C(C)C)CC12,C12H18O2,,194.130679816,PBWRFXQNNGSAQG,Terpenoids,Monoterpenoids,Thujane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,7.30095648765564 7586,1545,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,UEEFSWPSRLSUQJ-NOMYRAODSA-N,"InChI=1S/C25H31NO11/c1-2-15-16(8-7-14-5-3-9-26(11-14)10-4-6-19(28)29)17(23(33)34)13-35-24(15)37-25-22(32)21(31)20(30)18(12-27)36-25/h2-3,5,7-9,11,13,15-16,18,20-22,24-25,27,30-32H,1,4,6,10,12H2,(H-,28,29,33,34)/b8-7+/t15-,16+,18-,20-,21+,22-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCCC(=O)O)c1,C25H31NO11,pos_1_1proton1methanol,521.1897108119997,UEEFSWPSRLSUQJ,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7587,1545,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,QGCICTMJHHIGBT-LSWTWQANSA-N,"InChI=1S/C25H31NO11/c1-4-15-16(7-6-13-8-14(22(31)32)10-26(5-2)9-13)17(23(33)34-3)12-35-24(15)37-25-21(30)20(29)19(28)18(11-27)36-25/h4,6-10,12,15-16,18-21,24-25,27-30H,1,5,11H2,2-3H3/b7-6+/t15-,16+,18-,19-,20+,21-,24+,25+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1/C=C/c1cc(C(=O)[O-])c[n+](CC)c1,C25H31NO11,pos_1_1proton1methanol,521.1897108119998,QGCICTMJHHIGBT,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7588,1545,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,DRAPQDCEBKBPQE-ACFZRETJSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(13-4-6-16(29)18(8-13)34-2)26(14,11-36-23)38-25-22(32)21(31)20(30)19(9-27)37-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25+,26-/m1/s1",COc1cc([C@H]2OC[C@]3(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O,C26H32O12,pos_1_1proton1ammonium,536.1893764639999,DRAPQDCEBKBPQE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 7589,1545,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_1_1proton1ammonium,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 7590,1545,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_1_1proton1ammonium,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 7591,1545,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,GQLQVPZSTWXDBQ-ZOKOZUFBSA-N,"InChI=1S/C26H32O12/c1-33-17-8-13(3-5-15(17)28)24-26(32)11-36-23(14(26)10-35-24)12-4-6-16(18(7-12)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25-,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_1_1proton1ammonium,536.1893764639998,GQLQVPZSTWXDBQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,2,7.0 7592,1545,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,KPZWNZOLVDRTMM-YRDWWIAGSA-N,"InChI=1S/C26H32O12/c1-33-18-8-13(3-5-16(18)28)23-26(32)11-36-22(15(26)10-35-23)12-4-6-17(19(7-12)34-2)37-25-14(9-27)20(29)21(30)24(31)38-25/h3-8,14-15,20-25,27-32H,9-11H2,1-2H3/t14-,15-,20-,21+,22-,23-,24+,25+,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@H]5O[C@H](O)[C@@H](O)[C@H](O)[C@H]5CO)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_1_1proton1ammonium,536.189376464,KPZWNZOLVDRTMM,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,2,7.0 7593,1539,700,Amino acids and Peptides,Small peptides,Dipeptides,0.55340064,ISDB,IQHUITKNHOKGFC-MIMYLULJSA-N,"InChI=1S/C13H18N2O4/c1-8(16)11(14)12(17)15-10(13(18)19)7-9-5-3-2-4-6-9/h2-6,8,10-11,16H,7,14H2,1H3,(H,15,17)(H,18,19)/t8-,10+,11+/m1/s1",C[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,C13H18N2O4,,266.126657056,IQHUITKNHOKGFC,Amino acids and Peptides,Small peptides,Dipeptides,Saccharomyces cerevisiae,356221.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Unknown'],['Saccharomycetales'],['Saccharomycetaceae'],['Unknown'],['Saccharomyces'],['Saccharomyces cerevisiae'],1,3,4.713602542877197 7594,1535,1035,Terpenoids,Diterpenoids,Noreremophilane sesquiterpenoids,0.36242452,ISDB,USYVWERWVKDSSW-KXBDFOAZSA-N,"InChI=1S/C28H37NO3/c1-18-5-8-21-9-12-24-26(28(21,3)4)25(17-19(2)16-23(31)15-18)29(27(24)32)14-13-20-6-10-22(30)11-7-20/h6-7,10-11,16,21,23-24,30-31H,1,5,8-9,12-15,17H2,2-4H3/b19-16+/t21-,23+,24+/m1/s1",C=C1CC[C@@H]2CC[C@@H]3C(=O)N(CCc4ccc(O)cc4)C(=C3C2(C)C)C/C(C)=C/[C@@H](O)C1,C28H37NO3,,435.277344044,USYVWERWVKDSSW,Terpenoids,Diterpenoids,Verticillane diterpenoids,Conglomeratusclera coerulea,7507656.0,['Eukaryota'],['Metazoa'],['Cnidaria'],['Anthozoa'],['Alcyonacea'],['Xeniidae'],['Unknown'],['Conglomeratusclera'],['Conglomeratusclera coerulea'],1,2,3.4496980905532837 7595,1533,-1,,,,0.5049256,ISDB,NRBFZHKWPWGDAN-UHFFFAOYSA-N,"InChI=1S/C19H30O3/c1-5-17(2)12-9-13-14(22-17)7-8-15-18(13,3)10-6-11-19(15,4)16(20)21/h5,13-15H,1,6-12H2,2-4H3,(H,20,21)",C=CC1(C)CCC2C(CCC3C(C)(C(=O)O)CCCC23C)O1,C19H30O3,,306.21949482,NRBFZHKWPWGDAN,Terpenoids,Diterpenoids,Norlabdane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,8.019702434539795 7596,1532,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,1,6.5 7597,1532,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,1,6.5 7598,1532,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,1,6.5 7599,1532,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,1,6.5 7600,1531,171,Terpenoids,Sesquiterpenoids,Wax monoesters,0.0,MS1_match,XXZPXRQPWFAXCK-WQFMGJDKSA-N,"InChI=1S/C17H26O5/c1-10(2)7-15(19)22-17-16-11(3)5-6-14(16)13(9-21-17)8-20-12(4)18/h9-11,14,16-17H,5-8H2,1-4H3/t11-,14+,16+,17-/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1CC[C@@H]2C,C17H26O5,pos_1_minus1proton2sodium,310.178023932,XXZPXRQPWFAXCK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 7601,1527,-1,,,,0.6216725,ISDB,QHZLMUACJMDIAE-UHFFFAOYSA-N,"InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3",CCCCCCCCCCCCCCCC(=O)OCC(O)CO,C19H38O4,,330.277009696,QHZLMUACJMDIAE,Fatty acids,Glycerolipids,Monoacylglycerols,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,8.486690044403076 7602,1525,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2434469,ISDB,VRPFJYGFBAJGLE-NPMAGFNESA-N,"InChI=1S/C11H18O4/c1-8(10(13)15-4)6-5-7-11(3,14)9(2)12/h5-7,9,12,14H,1-4H3/b7-5+,8-6+/t9-,11-/m1/s1",COC(=O)/C(C)=C/C=C/[C@@](C)(O)[C@@H](C)O,C11H18O4,,214.120509056,VRPFJYGFBAJGLE,,,,Penicillium citreonigrum,927515.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium citreonigrum'],1,0,1.9737876057624817 7603,1525,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2434469,ISDB,VRPFJYGFBAJGLE-NPMAGFNESA-N,"InChI=1S/C11H18O4/c1-8(10(13)15-4)6-5-7-11(3,14)9(2)12/h5-7,9,12,14H,1-4H3/b7-5+,8-6+/t9-,11-/m1/s1",COC(=O)/C(C)=C/C=C/[C@@](C)(O)[C@@H](C)O,C11H18O4,,214.120509056,VRPFJYGFBAJGLE,,,,Penicillium citreoviride,927515.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium citreonigrum'],1,0,1.9737876057624817 7604,1524,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,CDKNUBLSEZJSAU-YIXWCVDNSA-N,"InChI=1S/C20H30O5/c1-17(15(21)22)7-3-8-20(16(23)24)13(17)6-9-19-10-12(4-5-14(19)20)18(2,25)11-19/h12-14,25H,3-11H2,1-2H3,(H,21,22)(H,23,24)/t12-,13-,14-,17-,18-,19+,20+/m1/s1",C[C@@]1(C(=O)O)CCC[C@@]2(C(=O)O)[C@@H]3CC[C@@H]4C[C@@]3(CC[C@@H]21)C[C@@]4(C)O,C20H30O5,pos_1_1proton1methanol,350.20932406,CDKNUBLSEZJSAU,Terpenoids,Diterpenoids,Gibberellins,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,1,6.5 7605,1522,566,Terpenoids,Monoterpenoids,Camphane monoterpenoids,0.0,MS1_match,UPJVQRZPXLZUET-KGHQQZOUSA-N,"InChI=1S/C28H46O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26,30)15-16-28(23,24)31/h7-8,15-16,18-24,29-31H,9-14,17H2,1-6H3/b8-7+/t19-,20+,21-,22+,23+,24+,25+,26+,27+,28-/m0/s1",CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@]3(O)C=C[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H46O3,pos_1_1proton1ammonium,430.344695332,UPJVQRZPXLZUET,Terpenoids,Steroids,Cholestane steroids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,1,6.5 7606,1521,-1,,,,0.0,MS1_match,AZJNCPIRHFRIFV-MWBBRCRPSA-N,"InChI=1S/C28H40O15/c1-5-12(8-29)13-7-18(37-3)42-26(36)20(13)25(35)40-16-6-14-15(24(34)38-4)10-39-27(19(14)11(16)2)43-28-23(33)22(32)21(31)17(9-30)41-28/h5,8,10-11,13-14,16-23,26-28,30-33,36H,6-7,9H2,1-4H3/b12-5-/t11-,13-,14+,16-,17+,18-,19+,20+,21+,22-,23+,26-,27-,28-/m0/s1",C/C=C(/C=O)[C@@H]1C[C@@H](OC)O[C@H](O)[C@H]1C(=O)O[C@H]1C[C@@H]2C(C(=O)OC)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2[C@H]1C,C28H40O15,pos_1_1proton1ammonium,616.23672058,AZJNCPIRHFRIFV,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,0,6.0 7607,1519,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.7618044,ISDB,RVEKLXYYCHAMDF-AOSYACOCSA-N,"InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h4-5,7-8H,2-3,6,9-15H2,1H3,(H,17,18)/b5-4+,8-7+",CCC/C=C/C/C=C/CCCCCCCC(=O)O,C16H28O2,,252.208930136,RVEKLXYYCHAMDF,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Asclepias syriaca,148395.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Asclepias'],['Asclepias syriaca'],4,2,8.047217607498169 7608,1514,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.30670404,ISDB,OUWXZGMEFZQYEK-WQLSENKSSA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(8-12(4)16(17)18)15-11(3)7-10(2)14(9)15/h8-10,13-14H,5-7H2,1-4H3,(H,17,18)/b12-8-",CC1=C2C(/C=C(/C)C(=O)O)CCC(C)C2C(C)C1,C16H24O2,,248.177630008,OUWXZGMEFZQYEK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.226816177368164 7609,1512,1502,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,AZUURFWEIQDHCN-MZGJNUFDSA-N,"InChI=1S/C40H44O22/c1-14-25(46)29(50)31(52)38(55-14)56-17-10-20(45)24-21(11-17)57-33(16-7-8-18(43)19(44)9-16)35(28(24)49)61-40-36(30(51)26(47)22(12-41)59-40)62-39-32(53)34(27(48)23(13-42)58-39)60-37(54)15-5-3-2-4-6-15/h2-11,14,22-23,25-27,29-32,34,36,38-48,50-53H,12-13H2,1H3/t14-,22+,23+,25-,26+,27+,29+,30-,31+,32+,34-,36+,38+,39-,40-/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](OC(=O)c5ccccc5)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C40H44O22,pos_2_2sodium,876.232423048,AZUURFWEIQDHCN,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium carolinianum,529153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carolinianum'],6,2,7.0 7610,1511,-1,,,,0.2225991,ISDB,CEDIUSJLGQLBRO-ITVDRDEASA-N,"InChI=1S/C40H56O6/c1-24-14-19-39(35(44)45)20-21-40(23-27(41)10-8-26-9-12-29(42)30(22-26)46-7)28(34(39)25(24)2)11-13-32-37(5)17-16-33(43)36(3,4)31(37)15-18-38(32,40)6/h8-12,22,24-25,31-34,42-43H,13-21,23H2,1-7H3,(H,44,45)/b10-8-/t24-,25+,31+,32-,33+,34+,37+,38-,39+,40+/m1/s1",COc1cc(/C=C\C(=O)C[C@@]23CC[C@@]4(C(=O)O)CC[C@@H](C)[C@H](C)[C@H]4C2=CC[C@@H]2[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@]23C)ccc1O,C40H56O6,,632.4076895119999,CEDIUSJLGQLBRO,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Uncaria rhynchophylla,985518.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Naucleeae'],['Uncaria'],['Uncaria rhynchophylla'],4,0,4.890396416187286 7611,1510,1119,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HHVCVAIASNFMBE-KVJIRVJXSA-N,"InChI=1S/C22H31ClO8/c1-12(2)6-18(25)30-17-8-16-15(9-28-14(5)24)10-29-21(20(16)22(17,27)11-23)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)CCl,C22H31ClO8,pos_1_1sodium1acetonitrile,458.170745632,HHVCVAIASNFMBE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 7612,1510,1119,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HHVCVAIASNFMBE-KVJIRVJXSA-N,"InChI=1S/C22H31ClO8/c1-12(2)6-18(25)30-17-8-16-15(9-28-14(5)24)10-29-21(20(16)22(17,27)11-23)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)CCl,C22H31ClO8,pos_1_1sodium1acetonitrile,458.170745632,HHVCVAIASNFMBE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7613,1510,1119,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QJRWKLJFMYNELF-KVJIRVJXSA-N,"InChI=1S/C22H31ClO8/c1-12(2)6-18(25)28-9-15-10-29-21(31-19(26)7-13(3)4)20-16(15)8-17(30-14(5)24)22(20,27)11-23/h8,10,12-13,17,20-21,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]1(O)CCl,C22H31ClO8,pos_1_1sodium1acetonitrile,458.170745632,QJRWKLJFMYNELF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,3,7.5 7614,1507,-1,,,,0.56599057,ISDB,HCDJTUMTMPSUBK-GXSJLCMTSA-N,"InChI=1S/C12H16O/c1-8-3-4-11-9(2)6-10(7-13)12(11)5-8/h5,7,9,11H,3-4,6H2,1-2H3/t9-,11+/m0/s1",CC1=CC2=C(C=O)C[C@H](C)[C@H]2CC1,C12H16O,,176.120115132,HCDJTUMTMPSUBK,Terpenoids,Sesquiterpenoids,,Artemisia baldshuanica,96263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia baldshuanica'],4,0,6.263962268829346 7615,1503,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.22448383,ISDB,BCJWMXDKQZDJOV-HDXZBMLESA-N,"InChI=1S/C33H54O13/c1-6-30(2)9-10-32(4)16(11-30)7-8-20-31(3,27(42)17(35)12-33(20,32)5)15-44-29-26(41)24(39)22(37)19(46-29)14-43-28-25(40)23(38)21(36)18(13-34)45-28/h6-7,17-29,34-42H,1,8-15H2,2-5H3/t17-,18-,19-,20+,21-,22-,23+,24-,25-,26+,27+,28+,29-,30+,31-,32+,33+/m1/s1",C=C[C@@]1(C)CC[C@@]2(C)C(=CC[C@H]3[C@@](C)(CO[C@@H]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@H](O)C[C@@]32C)C1,C33H54O13,,658.356441788,BCJWMXDKQZDJOV,Terpenoids,Triterpenoids,,Sagenomella striatispora,709980.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Sagenomella'],['Sagenomella striatispora'],1,1,2.3979353308677673 7616,1494,-1,,,,0.9061751,ISDB,JYVVXGYNFYHSER-UINNMSKDSA-N,"InChI=1S/C14H20O2/c1-8-10-7-13(2,3)5-9-6-14(9,4)11(10)12(15)16-8/h8-9H,5-7H2,1-4H3/t8-,9-,14+/m0/s1",C[C@@H]1OC(=O)C2=C1CC(C)(C)C[C@H]1C[C@@]21C,C14H20O2,,220.14632988,JYVVXGYNFYHSER,Terpenoids,Sesquiterpenoids,Africanane sesquiterpenoids,Porella swartziana,250779.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Jungermanniopsida'],['Porellales'],['Porellaceae'],['Unknown'],['Porella'],['Porella swartziana'],3,0,6.624700307846069 7617,1493,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.6855127,ISDB,XNJLQKDYYHRSAJ-UHFFFAOYSA-N,"InChI=1S/C16H30O3/c1-2-3-4-6-9-12-15(17)13-10-7-5-8-11-14-16(18)19/h9,12,15,17H,2-8,10-11,13-14H2,1H3,(H,18,19)",CCCCCC=CC(O)CCCCCCCC(=O)O,C16H30O3,,270.21949482,XNJLQKDYYHRSAJ,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Elaeagnus angustifolia,209044.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Elaeagnaceae'],['Unknown'],['Elaeagnus'],['Elaeagnus angustifolia'],4,3,8.242050886154175 7618,1491,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.28740084,ISDB,JVHYYZMBYJJGJM-ZMDGZUOKSA-N,"InChI=1S/C40H54O4/c1-29(17-13-19-31(3)21-22-35(42)38(9)26-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)27-34(44-40)28-39(40,10)43/h11-24,34,43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,38-,39+,40+/m0/s1",CC(/C=C/C=C(C)/C=C/C(=O)[C@]1(C)CC(=O)CC1(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@@H](CC1(C)C)C[C@@]2(C)O,C40H54O4,,598.402210208,JVHYYZMBYJJGJM,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-κ)",Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,6.149603366851807 7619,1490,109,Terpenoids,Diterpenoids,Estrane steroids,0.5831185,ISDB,XMGQNBFCAUFSGC-RXHMHPOJSA-N,"InChI=1S/C19H30O3/c1-13(11-20)5-7-15-14(2)6-8-16-18(15,3)10-9-17(22)19(16,4)12-21/h5,11,15-17,21-22H,2,6-10,12H2,1,3-4H3/b13-5+/t15-,16+,17+,18+,19-/m0/s1",C=C1CC[C@H]2[C@](C)(CO)[C@H](O)CC[C@]2(C)[C@H]1C/C=C(\C)C=O,C19H30O3,,306.21949482,XMGQNBFCAUFSGC,Terpenoids,Diterpenoids,Labdane diterpenoids,Croton laui,3913830.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton laui'],4,2,7.332473993301392 7620,1488,369,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.3450105,ISDB,OBECEYKERBWXFA-CNGPOQNKSA-N,"InChI=1S/C24H40O11/c1-11-7-13(8-24(3,4)14(11)6-5-12(2)25)34-23-21(31)19(29)18(28)16(35-23)10-33-22-20(30)17(27)15(26)9-32-22/h5-6,11,13-23,26-31H,7-10H2,1-4H3/b6-5+/t11-,13+,14+,15-,16-,17+,18-,19+,20-,21-,22+,23-/m1/s1",CC(=O)/C=C/[C@H]1[C@H](C)C[C@H](O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C24H40O11,,504.2570621,OBECEYKERBWXFA,Terpenoids,Apocarotenoids,Megastigmanes,Alangium premnifolium,6045450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Cornaceae'],['Unknown'],['Alangium'],['Alangium premnifolium'],4,1,5.88004195690155 7621,1487,-1,,,,0.0,MS1_match,GYTISTMGTHKMCE-RMHXPDDSSA-N,"InChI=1S/C15H20O4/c1-7-5-8(16)6-9-10(17)11-12(19-11)13(14(2,3)18)15(7,9)4/h6-7,11-13,18H,5H2,1-4H3/t7-,11-,12-,13+,15+/m1/s1",C[C@@H]1CC(=O)C=C2C(=O)[C@H]3O[C@H]3[C@@H](C(C)(C)O)[C@]21C,C15H20O4,pos_1_1proton,264.13615912,GYTISTMGTHKMCE,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7622,1487,-1,,,,0.0,MS1_match,JVAVVXRDSNKYPD-UHFFFAOYSA-N,"InChI=1S/C15H20O4/c1-9-4-3-5-11(15(17)18)7-12-8-13(12)14(6-9)19-10(2)16/h4,7,12-14H,3,5-6,8H2,1-2H3,(H,17,18)",CC(=O)OC1CC(C)=CCCC(C(=O)O)=CC2CC21,C15H20O4,pos_1_1proton,264.13615912,JVAVVXRDSNKYPD,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7623,1487,-1,,,,0.0,MS1_match,JVAVVXRDSNKYPD-UHFFFAOYSA-N,"InChI=1S/C15H20O4/c1-9-4-3-5-11(15(17)18)7-12-8-13(12)14(6-9)19-10(2)16/h4,7,12-14H,3,5-6,8H2,1-2H3,(H,17,18)",CC(=O)OC1CC(C)=CCCC(C(=O)O)=CC2CC21,C15H20O4,pos_1_1proton,264.13615912,JVAVVXRDSNKYPD,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 7624,1485,753,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5283866,ISDB,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,10.613546371459961 7625,1485,753,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5283866,ISDB,GWCSSLSMGCFIFR-GWKPYITFSA-N,"InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1",COc1cc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)ccc1O,C20H20O6,,356.12598835999995,GWCSSLSMGCFIFR,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,3,10.613546371459961 7626,1482,38,Terpenoids,Steroids,Cholestane steroids,0.57563674,ISDB,DPUOLQHDNGRHBS-KTKRTIGZSA-N,"InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-",CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O,C22H42O2,,338.318480584,DPUOLQHDNGRHBS,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,8.302546977996826 7627,1479,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HMTVXYYWICMXMY-YSVDCJIHSA-N,"InChI=1S/C15H26O3/c1-8-5-11(16)13-9(8)6-10-12(17)7-15(13,4)18-14(10,2)3/h8-13,16-17H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O3,pos_1_1proton1methanol,254.188194692,HMTVXYYWICMXMY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7628,1479,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,HMTVXYYWICMXMY-YSVDCJIHSA-N,"InChI=1S/C15H26O3/c1-8-5-11(16)13-9(8)6-10-12(17)7-15(13,4)18-14(10,2)3/h8-13,16-17H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,13+,15+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@@H]1C[C@H]1[C@@H](O)C[C@]2(C)OC1(C)C,C15H26O3,pos_1_1proton1methanol,254.188194692,HMTVXYYWICMXMY,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 7629,1478,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_1_1proton1acetonitrile,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,1,6.5 7630,1478,121,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_1_1proton1acetonitrile,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 7631,1475,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,OYHQOLUKZRVURQ-AVQMFFATSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6+,10-9+",CCCCC/C=C/C/C=C/CCCCCCCC(=O)O,C18H32O2,pos_1_1proton1acetonitrile,280.240230264,OYHQOLUKZRVURQ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,3,7.5 7632,1475,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,OYHQOLUKZRVURQ-HZJYTTRNSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)O,C18H32O2,pos_1_1proton1acetonitrile,280.240230264,OYHQOLUKZRVURQ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,3,7.5 7633,1475,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ADHNUPOJJCKWRT-JLXBFWJWSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h14-17H,2-13H2,1H3,(H,19,20)/b15-14+,17-16+",CCCCCCCCCCCCC/C=C/C=C/C(=O)O,C18H32O2,pos_1_1proton1acetonitrile,280.240230264,ADHNUPOJJCKWRT,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,3,7.5 7634,1472,-1,,,,0.61692846,ISDB,NDGSLRUFUIEVLM-HDWLWNEUSA-N,"InChI=1S/C35H40O11/c1-20-17-27(44-31(39)24-13-9-7-10-14-24)30(43-23(4)38)34(19-41-21(2)36)28(45-32(40)25-15-11-8-12-16-25)18-26-29(42-22(3)37)35(20,34)46-33(26,5)6/h7-16,20,26-30H,17-19H2,1-6H3/t20-,26-,27+,28+,29-,30+,34-,35-/m1/s1",CC(=O)OC[C@]12[C@@H](OC(=O)c3ccccc3)C[C@@H]3[C@@H](OC(C)=O)[C@]1(OC3(C)C)[C@H](C)C[C@H](OC(=O)c1ccccc1)[C@@H]2OC(C)=O,C35H40O11,,636.2570620999999,NDGSLRUFUIEVLM,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,0,8.467713832855225 7635,1466,-1,,,,0.20372832,ISDB,,,,,,,FJZPPPWZKPBNIE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.814913272857666 7636,1465,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.5097636,ISDB,XYVMMUYIQOLBNH-ZVWIDNOQSA-N,"InChI=1S/C18H34O5/c1-2-3-4-5-6-7-8-10-15(19)13-14-17(21)16(20)11-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)/b14-13+/t15-,16-,17+/m1/s1",CCCCCCCCC[C@@H](O)/C=C/[C@H](O)[C@H](O)CCCC(=O)O,C18H34O5,,330.240624188,XYVMMUYIQOLBNH,Fatty acids,Octadecanoids,Other Octadecanoids,Codonopsis pilosula,1014057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Campanulaceae'],['Unknown'],['Codonopsis'],['Codonopsis pilosula'],4,1,6.5390543937683105 7637,1464,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],4,3,8.499311685562134 7638,1464,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Cymbopogon flexuosus,186966.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Andropogoneae'],['Cymbopogon'],['Cymbopogon flexuosus'],4,3,8.499311685562134 7639,1464,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],4,3,8.499311685562134 7640,1464,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],4,3,8.499311685562134 7641,1464,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Rhododendron groenlandicum,649881.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Rhodoreae'],['Rhododendron'],['Rhododendron groenlandicum'],4,3,8.499311685562134 7642,1464,1432,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,0.7498279,ISDB,RJZWGDPBGWGJNU-MTXIQXFFSA-N,"InChI=1S/C15H22O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8-9,11,13-14H,4-7H2,1-3H3/b10-8+/t11-,13+,14-/m1/s1",CC1=C2[C@H](/C=C(\C)C=O)CC[C@@H](C)[C@H]2CC1,C15H22O,,218.167065324,RJZWGDPBGWGJNU,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Rhododendron tomentosum,945421.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Rhodoreae'],['Rhododendron'],['Rhododendron tomentosum'],4,3,8.499311685562134 7643,1458,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,CRZQGDNQQAALAY-UHFFFAOYSA-N,"InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3",COC(=O)Cc1ccccc1,C9H10O2,pos_1_1proton,150.06807956,CRZQGDNQQAALAY,Shikimates and Phenylpropanoids,,,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7644,1458,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XDMOPVQNPWVPSX-UHFFFAOYSA-N,"InChI=1S/C8H6O/c9-8-5-2-1-3(5)7(8)4(1)6(2)8/h1-3,5-6,9H",OC12C3=C4C5C3C1C5C42,C8H6O,pos_1_1proton1methanol,118.041864812,XDMOPVQNPWVPSX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 7645,1456,-1,,,,0.0,MS1_match,HRJAUSFIYSBLLI-VODSTRMTSA-N,"InChI=1S/C35H40O10/c1-21(36)41-26-20-33(5,40)35-29(42-22(2)37)25(32(3,4)45-35)19-27(43-31(39)24-15-11-8-12-16-24)34(35,6)30(26)44-28(38)18-17-23-13-9-7-10-14-23/h7-18,25-27,29-30,40H,19-20H2,1-6H3/b18-17+/t25-,26+,27+,29-,30+,33+,34-,35+/m1/s1",CC(=O)O[C@H]1C[C@](C)(O)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(C)[C@H]1OC(=O)/C=C/c1ccccc1)[C@H]3OC(C)=O,C35H40O10,pos_1_sodium,620.26214748,HRJAUSFIYSBLLI,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,0,7.0 7646,1456,-1,,,,0.0,MS1_match,RACYNKLBFZMILD-UHFFFAOYSA-N,"InChI=1S/C35H40O10/c1-22(36)41-21-34-28(43-29(38)17-16-24-12-8-6-9-13-24)18-26-19-35(34,45-32(26,3)4)33(5,40)20-27(42-23(2)37)30(34)44-31(39)25-14-10-7-11-15-25/h6-17,26-28,30,40H,18-21H2,1-5H3",CC(=O)OCC12C(OC(=O)C=Cc3ccccc3)CC3CC1(OC3(C)C)C(C)(O)CC(OC(C)=O)C2OC(=O)c1ccccc1,C35H40O10,pos_1_sodium,620.26214748,RACYNKLBFZMILD,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,0,7.0 7647,1455,163,Terpenoids,Monoterpenoids,Oleanane triterpenoids,0.0,MS1_match,NRWUTPXRYNUSMI-XOLXQSKQSA-N,"InChI=1S/C17H30O9/c1-7-8-4-11(19)17(2,9(8)6-24-15(7)23-3)26-16-14(22)13(21)12(20)10(5-18)25-16/h7-16,18-22H,4-6H2,1-3H3/t7-,8-,9+,10-,11-,12-,13+,14-,15-,16+,17+/m1/s1",CO[C@@H]1OC[C@H]2[C@H](C[C@@H](O)[C@@]2(C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1C,C17H30O9,pos_1_1proton1acetonitrile,378.18898254,NRWUTPXRYNUSMI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,2,7.0 7648,1453,-1,,,,0.0,MS1_match,UPJVQRZPXLZUET-KGHQQZOUSA-N,"InChI=1S/C28H46O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26,30)15-16-28(23,24)31/h7-8,15-16,18-24,29-31H,9-14,17H2,1-6H3/b8-7+/t19-,20+,21-,22+,23+,24+,25+,26+,27+,28-/m0/s1",CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@]3(O)C=C[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H46O3,pos_1_1proton1methanol,430.344695332,UPJVQRZPXLZUET,Terpenoids,Steroids,Cholestane steroids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 7649,1451,406,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,VTCDZPUMZAZMSB-UHFFFAOYSA-N,"InChI=1S/C9H12O4/c1-11-7-4-6(10)5-8(12-2)9(7)13-3/h4-5,10H,1-3H3",COc1cc(O)cc(OC)c1OC,C9H12O4,pos_1_1proton1ammonium,184.073558864,VTCDZPUMZAZMSB,,,,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 7650,1448,700,Amino acids and Peptides,Small peptides,Dipeptides,0.6769913,ISDB,PPQRSMGDOHLTBE-UWVGGRQHSA-N,"InChI=1S/C12H16N2O4/c13-9(7-15)11(16)14-10(12(17)18)6-8-4-2-1-3-5-8/h1-5,9-10,15H,6-7,13H2,(H,14,16)(H,17,18)/t9-,10-/m0/s1",N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,C12H16N2O4,,252.111006992,PPQRSMGDOHLTBE,Amino acids and Peptides,Small peptides,Dipeptides,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.20796513557434 7651,1447,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BKKCPVJHKOCEPK-KVJIRVJXSA-N,"InChI=1S/C22H32O9/c1-12(2)6-18(25)30-17-8-16-15(9-28-14(5)24)10-29-21(20(16)22(17,27)11-23)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,23,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)CO,C22H32O9,pos_1_sodium,440.2046326039999,BKKCPVJHKOCEPK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7652,1447,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BKKCPVJHKOCEPK-KVJIRVJXSA-N,"InChI=1S/C22H32O9/c1-12(2)6-18(25)30-17-8-16-15(9-28-14(5)24)10-29-21(20(16)22(17,27)11-23)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,23,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)CO,C22H32O9,pos_1_sodium,440.2046326039999,BKKCPVJHKOCEPK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7653,1447,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,AOLKDXFBABOMHP-ADNIJMRFSA-N,"InChI=1S/C22H32O9/c1-12(2)6-17(24)27-9-15-10-28-20(31-18(25)7-13(3)4)19-21(15,26)8-16(30-14(5)23)22(19)11-29-22/h10,12-13,16,19-20,26H,6-9,11H2,1-5H3/t16-,19-,20-,21-,22+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H32O9,pos_1_sodium,440.2046326039999,AOLKDXFBABOMHP,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7654,1447,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OEAZFPVJNXNHSX-KVJIRVJXSA-N,"InChI=1S/C22H32O9/c1-12(2)6-18(25)30-11-22(27)17(24)8-16-15(9-28-14(5)23)10-29-21(20(16)22)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,24,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](O)[C@]2(O)COC(=O)CC(C)C,C22H32O9,pos_1_sodium,440.2046326039999,OEAZFPVJNXNHSX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7655,1447,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OEAZFPVJNXNHSX-KVJIRVJXSA-N,"InChI=1S/C22H32O9/c1-12(2)6-18(25)30-11-22(27)17(24)8-16-15(9-28-14(5)23)10-29-21(20(16)22)31-19(26)7-13(3)4/h8,10,12-13,17,20-21,24,27H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](O)[C@]2(O)COC(=O)CC(C)C,C22H32O9,pos_1_sodium,440.2046326039999,OEAZFPVJNXNHSX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7656,1437,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.8391845,ISDB,BVJSKAUUFXBDOB-UHFFFAOYSA-N,"InChI=1S/C22H45O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(26)29-17-21(25)19-31-32(27,28)30-18-20(24)16-23/h20-21,23-25H,2-19H2,1H3,(H,27,28)",CCCCCCCCCCCCCCCC(=O)OCC(O)COP(=O)(O)OCC(O)CO,C22H45O9P,,484.2801196499999,BVJSKAUUFXBDOB,Fatty acids,Glycerophospholipids,Glycerophosphoglycerols,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,1,7.856738090515137 7657,1432,211,Amino acids and Peptides,Small peptides,Dipeptides,0.31506065,ISDB,UWDIQZJVMAKUPJ-LWKPJOBUSA-N,"InChI=1S/C20H30N2O3/c1-6-15(4)18(23)20(25)22(5)17(14(2)3)19(24)21-13-12-16-10-8-7-9-11-16/h7-11,14-15,17H,6,12-13H2,1-5H3,(H,21,24)/t15?,17-/m0/s1",CCC(C)C(=O)C(=O)N(C)[C@H](C(=O)NCCc1ccccc1)C(C)C,C20H30N2O3,,346.22564282,UWDIQZJVMAKUPJ,Amino acids and Peptides,Small peptides,Dipeptides,Xenorhabdus,332312.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Gammaproteobacteria'],['Enterobacteriales'],['Morganellaceae'],['Unknown'],['Xenorhabdus'],['Unknown'],0,3,2.7602425813674927 7658,1431,211,Amino acids and Peptides,Small peptides,Dipeptides,0.31506065,ISDB,UWDIQZJVMAKUPJ-LWKPJOBUSA-N,"InChI=1S/C20H30N2O3/c1-6-15(4)18(23)20(25)22(5)17(14(2)3)19(24)21-13-12-16-10-8-7-9-11-16/h7-11,14-15,17H,6,12-13H2,1-5H3,(H,21,24)/t15?,17-/m0/s1",CCC(C)C(=O)C(=O)N(C)[C@H](C(=O)NCCc1ccccc1)C(C)C,C20H30N2O3,,346.22564282,UWDIQZJVMAKUPJ,Amino acids and Peptides,Small peptides,Dipeptides,Xenorhabdus,332312.0,['Bacteria'],['Unknown'],['Proteobacteria'],['Gammaproteobacteria'],['Enterobacteriales'],['Morganellaceae'],['Unknown'],['Xenorhabdus'],['Unknown'],0,3,2.7602425813674927 7659,1423,-1,,,,0.23233779,ISDB,,,,,,,QPKRNPOEOOWPKT,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9293511509895325 7660,1422,-1,,,,0.6150983,ISDB,,,,,,,ZHWXAOZKNCMTES,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.460393190383911 7661,1421,80,Terpenoids,Steroids,Spirostane steroids,0.4483795,ISDB,BIIBZAQPPUWOPA-NGFJZNNZSA-N,"InChI=1S/C44H58O6/c1-28(2)15-11-17-30(5)19-13-20-32(7)22-26-43-36(45)27-33(8)41(47)44(43,48)50-39-35-23-25-42(10,49-40(35)38(46)34(9)37(39)43)24-14-21-31(6)18-12-16-29(3)4/h15-16,19,21-23,25,27,46,48H,11-14,17-18,20,24,26H2,1-10H3/b30-19+,31-21+,32-22+/t42-,43?,44?/m1/s1",CC(C)=CCC/C(C)=C/CC/C(C)=C/CC12C(=O)C=C(C)C(=O)C1(O)Oc1c3c(c(O)c(C)c12)O[C@](C)(CC/C=C(\C)CCC=C(C)C)C=C3,C44H58O6,,682.423339576,BIIBZAQPPUWOPA,Polyketides,Meroterpenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),Albatrellus ovinus,140762.0,['Eukaryota'],['Fungi'],['Basidiomycota'],['Agaricomycetes'],['Russulales'],['Albatrellaceae'],['Unknown'],['Albatrellus'],['Albatrellus ovinus'],1,0,2.7935179471969604 7662,1419,-1,,,,0.0,MS1_match,YYXXGJKFOHXSML-QEJZJMRPSA-N,"InChI=1S/C15H20O2/c1-13(2)12-8-7-11(16)10-6-5-9-14(3,17-13)15(10,12)4/h6-8,12H,5,9H2,1-4H3/t12-,14-,15-/m0/s1",CC1(C)O[C@@]2(C)CCC=C3C(=O)C=C[C@@H]1[C@]32C,C15H20O2,pos_1_1proton1methanol,232.14632988,YYXXGJKFOHXSML,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7663,1415,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7695348,ISDB,AHANXAKGNAKFSK-UHFFFAOYSA-N,"InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)",CCC=CCC=CCC=CCCCCCCCCCC(=O)O,C20H34O2,,306.255880328,AHANXAKGNAKFSK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Punica granatum,646814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Punica'],['Punica granatum'],4,3,8.578139305114746 7664,1415,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7695348,ISDB,AHANXAKGNAKFSK-PDBXOOCHSA-N,"InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O,C20H34O2,,306.255880328,AHANXAKGNAKFSK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Elaeis guineensis,947656.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Arecales'],['Arecaceae'],['Cocoseae'],['Elaeis'],['Elaeis guineensis'],4,3,8.578139305114746 7665,1415,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7695348,ISDB,AHANXAKGNAKFSK-UHFFFAOYSA-N,"InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)",CCC=CCC=CCC=CCCCCCCCCCC(=O)O,C20H34O2,,306.255880328,AHANXAKGNAKFSK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Prunus avium,162547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus avium'],4,3,8.578139305114746 7666,1412,636,Polyketides,Aromatic polyketides,Catechols with side chains,0.38180345,ISDB,FGPOGAUCGOZVPS-XBLVEGMJSA-N,"InChI=1S/C18H26O/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(19)16-14-17/h7-10,13-16,19H,2-6,11-12H2,1H3/b8-7+,10-9+",CCCCCC/C=C/C=C/CCc1ccc(O)cc1,C18H26O,,258.198365452,FGPOGAUCGOZVPS,Polyketides,Aromatic polyketides,Catechols with side chains,Piper villiramulum,865488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper villiramulum'],4,3,7.02721381187439 7667,1411,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.44808087,ISDB,JIUJVEDQFZYETQ-RCZWDNKTSA-N,"InChI=1S/C16H20O8/c17-6-12-13(20)14(21)15(22)16(24-12)23-11-4-3-10(19)8-2-1-7(18)5-9(8)11/h1-2,5,11-18,20-22H,3-4,6H2/t11-,12+,13+,14-,15+,16+/m0/s1",O=C1CC[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(O)ccc21,C16H20O8,,340.1158175999999,JIUJVEDQFZYETQ,Polyketides,Naphthalenes,Naphthalenones,Juglans mandshurica,70093.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Juglans'],['Juglans mandshurica'],4,0,5.792323470115662 7668,1410,484,Polyketides,Meroterpenoids,Ophiobolane sesterterpenoids,0.24122344,ISDB,MNTJKNWRCITJMY-JCBJYGFASA-N,"InChI=1S/C25H34O4/c1-15(2)10-19-12-17(4)24(29-19)9-8-23(5)13-20-16(3)11-22(27)25(20,28)18(14-26)6-7-21(23)24/h6,10-11,14,17,19-21,28H,7-9,12-13H2,1-5H3/b18-6-/t17-,19-,20+,21+,23+,24-,25-/m0/s1",CC(C)=C[C@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@]4(O)/C(C=O)=C\C[C@H]32)O1,C25H34O4,,398.245709568,MNTJKNWRCITJMY,Terpenoids,Sesterterpenoids,Ophiobolane sesterterpenoids,Bipolaris oryzae,448808.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Pleosporaceae'],['Unknown'],['Bipolaris'],['Bipolaris oryzae'],1,3,3.4648937582969666 7669,1409,1555,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JZBNMSVUZKTTOR-UHFFFAOYSA-N,"InChI=1S/C29H33NO4/c1-15-10-28-13-18-24-27(2)11-17(31)12-29(24)25(28)22(33)20(15)23(21(28)26(29)30(18)14-27)34-19(32)9-8-16-6-4-3-5-7-16/h3-9,17-18,20-26,31,33H,1,10-14H2,2H3",C=C1CC23CC4C5C6(C)CC(O)CC57C(C2C(OC(=O)C=Cc2ccccc2)C1C(O)C37)N4C6,C29H33NO4,pos_1_1proton1ethylamine,459.240958536,JZBNMSVUZKTTOR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum palmatum,698584.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum palmatum'],6,3,7.5 7670,1408,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.29172176,ISDB,GFKKBNXSTILZPT-LURJTMIESA-N,"InChI=1S/C11H12O3/c1-6-4-11(13)14-10-3-7(2)9(12)5-8(6)10/h3,5-6,12H,4H2,1-2H3/t6-/m0/s1",Cc1cc2c(cc1O)[C@@H](C)CC(=O)O2,C11H12O3,,192.078644244,GFKKBNXSTILZPT,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Heritiera ornithocephala,6118824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Heritiera'],['Heritiera ornithocephala'],4,3,6.666887044906616 7671,1407,458,Terpenoids,Apocarotenoids,Megastigmanes,0.33028385,ISDB,DQQUPMXQGJRNAW-HYPVQEEESA-N,"InChI=1S/C24H38O11/c1-12-7-14(26)8-23(3,4)15(12)6-5-13(2)34-21-19(29)18(28)17(27)16(35-21)9-32-22-20(30)24(31,10-25)11-33-22/h5-7,13,15-22,25,27-31H,8-11H2,1-4H3/b6-5+/t13-,15+,16-,17-,18+,19-,20+,21+,22-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O11,,502.241412036,DQQUPMXQGJRNAW,Terpenoids,Apocarotenoids,Megastigmanes,Cydonia oblonga,941743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Cydonia'],['Cydonia oblonga'],4,3,6.821135401725769 7672,1407,458,Terpenoids,Apocarotenoids,Megastigmanes,0.33028385,ISDB,DQQUPMXQGJRNAW-HYPVQEEESA-N,"InChI=1S/C24H38O11/c1-12-7-14(26)8-23(3,4)15(12)6-5-13(2)34-21-19(29)18(28)17(27)16(35-21)9-32-22-20(30)24(31,10-25)11-33-22/h5-7,13,15-22,25,27-31H,8-11H2,1-4H3/b6-5+/t13-,15+,16-,17-,18+,19-,20+,21+,22-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O11,,502.241412036,DQQUPMXQGJRNAW,Terpenoids,Apocarotenoids,Megastigmanes,Cydonia vulgaris,316549.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Chaenomeles'],['Chaenomeles sinensis'],4,3,6.821135401725769 7673,1407,458,Terpenoids,Apocarotenoids,Megastigmanes,0.33028385,ISDB,DQQUPMXQGJRNAW-LCIZJANLSA-N,"InChI=1S/C24H38O11/c1-12-7-14(26)8-23(3,4)15(12)6-5-13(2)34-21-19(29)18(28)17(27)16(35-21)9-32-22-20(30)24(31,10-25)11-33-22/h5-7,13,15-22,25,27-31H,8-11H2,1-4H3/b6-5+/t13-,15+,16-,17-,18+,19-,20+,21-,22-,24-/m1/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H38O11,,502.241412036,DQQUPMXQGJRNAW,Terpenoids,Apocarotenoids,Megastigmanes,Alangium premnifolium,6045450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Cornaceae'],['Unknown'],['Alangium'],['Alangium premnifolium'],4,3,6.821135401725769 7674,1405,-1,,,,0.62748826,ISDB,,,,,,,ORDIPLSZZYDBSA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.509953022003174 7675,1404,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,pos_1_1proton1methanol,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 7676,1404,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,UYGYXBOUYJLANA-CCXSFMJYSA-N,"InChI=1S/C11H14O3/c1-6-4-7(12)5-8-9(13)2-3-10(14)11(6)8/h2-3,5-7,10-12,14H,4H2,1H3/t6-,7-,10-,11+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C=C[C@@H](O)[C@H]21,C11H14O3,pos_1_1proton1methanol,194.094294308,UYGYXBOUYJLANA,Terpenoids,,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 7677,1399,-1,,,,0.9412416,ISDB,WWZTYXORWVAPSU-GTTSAUCSSA-N,"InChI=1S/C16H24O2/c1-10-5-7-15(4)9-12-11(13(17)18)6-8-16(10,12)14(15,2)3/h10H,5-9H2,1-4H3,(H,17,18)/t10-,15-,16+/m1/s1",C[C@@H]1CC[C@]2(C)CC3=C(C(=O)O)CC[C@@]31C2(C)C,C16H24O2,,248.177630008,WWZTYXORWVAPSU,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Sandwithia guyanensis,786217.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Aleuritideae'],['Sandwithia'],['Sandwithia guyanensis'],4,0,7.7649664878845215 7678,1399,-1,,,,0.9412416,ISDB,WWZTYXORWVAPSU-GTTSAUCSSA-N,"InChI=1S/C16H24O2/c1-10-5-7-15(4)9-12-11(13(17)18)6-8-16(10,12)14(15,2)3/h10H,5-9H2,1-4H3,(H,17,18)/t10-,15-,16+/m1/s1",C[C@@H]1CC[C@]2(C)CC3=C(C(=O)O)CC[C@@]31C2(C)C,C16H24O2,,248.177630008,WWZTYXORWVAPSU,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Cladogynos orientalis,3914748.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Epiprineae'],['Cladogynos'],['Cladogynos orientalis'],4,0,7.7649664878845215 7679,1399,-1,,,,0.9412416,ISDB,WWZTYXORWVAPSU-GTTSAUCSSA-N,"InChI=1S/C16H24O2/c1-10-5-7-15(4)9-12-11(13(17)18)6-8-16(10,12)14(15,2)3/h10H,5-9H2,1-4H3,(H,17,18)/t10-,15-,16+/m1/s1",C[C@@H]1CC[C@]2(C)CC3=C(C(=O)O)CC[C@@]31C2(C)C,C16H24O2,,248.177630008,WWZTYXORWVAPSU,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Croton aromaticus,3913775.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton aromaticus'],4,0,7.7649664878845215 7680,1399,-1,,,,0.9412416,ISDB,WWZTYXORWVAPSU-GTTSAUCSSA-N,"InChI=1S/C16H24O2/c1-10-5-7-15(4)9-12-11(13(17)18)6-8-16(10,12)14(15,2)3/h10H,5-9H2,1-4H3,(H,17,18)/t10-,15-,16+/m1/s1",C[C@@H]1CC[C@]2(C)CC3=C(C(=O)O)CC[C@@]31C2(C)C,C16H24O2,,248.177630008,WWZTYXORWVAPSU,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Joannesia princeps,485781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Jatropheae'],['Joannesia'],['Joannesia princeps'],4,0,7.7649664878845215 7681,1399,-1,,,,0.9412416,ISDB,WWZTYXORWVAPSU-GTTSAUCSSA-N,"InChI=1S/C16H24O2/c1-10-5-7-15(4)9-12-11(13(17)18)6-8-16(10,12)14(15,2)3/h10H,5-9H2,1-4H3,(H,17,18)/t10-,15-,16+/m1/s1",C[C@@H]1CC[C@]2(C)CC3=C(C(=O)O)CC[C@@]31C2(C)C,C16H24O2,,248.177630008,WWZTYXORWVAPSU,Terpenoids,Sesquiterpenoids,Patchoulane sesquiterpenoids,Croton crassifolius,850988.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton crassifolius'],4,0,7.7649664878845215 7682,1398,69,Terpenoids,Sesquiterpenoids,Furans,0.56750405,ISDB,CTLVRIOTFRWXKP-BGTYHANMSA-N,"InChI=1S/C18H28O/c1-13-7-6-8-16-17(13,4)11-9-14(2)18(16,5)12-10-15(3)19/h6-7,14,16H,1,8-12H2,2-5H3/t14-,16-,17+,18+/m1/s1",C=C1C=CC[C@H]2[C@@](C)(CCC(C)=O)[C@H](C)CC[C@@]12C,C18H28O,,260.214015516,CTLVRIOTFRWXKP,Terpenoids,Sesquiterpenoids,,Parentucellia latifolia,981066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Rhinantheae'],['Parentucellia'],['Parentucellia latifolia'],4,2,7.270016193389893 7683,1394,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.35865673,ISDB,HSLJXOGNOJMDIV-OEISXWRRSA-N,"InChI=1S/C25H42O9/c1-7-25(6,13-9-12-16(2)10-8-11-17(3)14-26)34-24-23(32-19(5)28)22(30)21(29)20(33-24)15-31-18(4)27/h7,12,17,20-24,26,29-30H,1,8-11,13-15H2,2-6H3/b16-12+/t17-,20+,21+,22-,23+,24-,25+/m0/s1",C=C[C@](C)(CC/C=C(\C)CCC[C@H](C)CO)O[C@@H]1O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]1OC(C)=O,C25H42O9,,486.282882924,HSLJXOGNOJMDIV,Terpenoids,Sesquiterpenoids,Farnesane sesquiterpenoids,Gaillardia aestivalis,388634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Helenieae'],['Gaillardia'],['Gaillardia aestivalis'],4,1,5.934626936912537 7684,1393,-1,,,,0.0,MS1_match,ZNQFUVKAKSTVGH-UHFFFAOYSA-N,"InChI=1S/C30H40O4/c1-18-19-8-10-28(4)21(20(19)16-22(31)24(18)32)9-11-29(5)23-17-27(3,25(33)34-7)13-12-26(23,2)14-15-30(28,29)6/h8-10,16,23,31-32H,11-15,17H2,1-7H3",COC(=O)C1(C)CCC2(C)CCC3(C)C4(C)C=Cc5c(cc(O)c(O)c5C)C4=CCC3(C)C2C1,C30H40O4,pos_2_2proton,464.29265976,ZNQFUVKAKSTVGH,Terpenoids,,,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 7685,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-UHFFFAOYSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3",COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)C4(C)CCC3(C)C2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Salacia kraussii,981087.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia kraussii'],6,0,6.0 7686,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Gymnosporia senegalensis,170566.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia senegalensis'],6,0,6.0 7687,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Hippocratea volubilis,232493.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Hippocratea'],['Hippocratea volubilis'],6,0,6.0 7688,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Orthosphenia mexicana,755524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Orthosphenia'],['Orthosphenia mexicana'],6,0,6.0 7689,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 7690,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia retusa,7631457.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia retusa'],6,0,6.0 7691,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia aquifolium,1060183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia aquifolia'],6,0,6.0 7692,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Salacia beddomei,278623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia beddomei'],6,0,6.0 7693,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Kokoona reflexa,5750149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Kokoona'],['Kokoona reflexa'],6,0,6.0 7694,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus chubutensis,6092930.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus chubutensis'],6,0,6.0 7695,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,0,6.0 7696,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus amazonica,6092911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia amazonica'],6,0,6.0 7697,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Pleurostylia opposita,907103.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Pleurostylia'],['Pleurostylia opposita'],6,0,6.0 7698,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Gymnosporia emarginata,35854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia inermis'],6,0,6.0 7699,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Kokoona zeylanica,6092887.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Kokoona'],['Kokoona zeylanica'],6,0,6.0 7700,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Peritassa campestris,381948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Peritassa'],['Peritassa campestris'],6,0,6.0 7701,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia catingarum,6092926.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia catingarum'],6,0,6.0 7702,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Crossopetalum gaumeri,1091453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Crossopetalum'],['Crossopetalum gaumeri'],6,0,6.0 7703,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 7704,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,0,6.0 7705,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 7706,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,0,6.0 7707,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Reissantia buchananii,380816.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Reissantia'],['Reissantia buchananii'],6,0,6.0 7708,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Tricerma vitis-idaeum,5750125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tricerma'],['Tricerma vitis-idaeum'],6,0,6.0 7709,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Salacia reticulata,5750051.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia reticulata'],6,0,6.0 7710,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia macrocarpa,7631453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia macrocarpa'],6,0,6.0 7711,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-UHFFFAOYSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3",COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)C4(C)CCC3(C)C2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus canariensis,458948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia cassinoides'],6,0,6.0 7712,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Gymnosporia dryandri,6092733.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia dryandri'],6,0,6.0 7713,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus umbellata,6092733.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Gymnosporia'],['Gymnosporia dryandri'],6,0,6.0 7714,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,0,6.0 7715,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus scutioides,6093023.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus scutioides'],6,0,6.0 7716,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus spinosa,995600.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia spinosa'],6,0,6.0 7717,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Monteverdia spinosa,995600.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia spinosa'],6,0,6.0 7718,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Celastraceae,601168.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Unknown'],['Unknown'],6,0,6.0 7719,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Lophopetalum wightianum,5513377.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lophopetalum'],['Lophopetalum wightianum'],6,0,6.0 7720,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus magellanica,433237.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus magellanica'],6,0,6.0 7721,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Cheiloclinium hippocrateoides,6093280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Cheiloclinium'],['Cheiloclinium hippocrateoides'],6,0,6.0 7722,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Maytenus woodsonii,433240.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus woodsonii'],6,0,6.0 7723,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,0,6.0 7724,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Cheiloclinium cognatum,583081.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Cheiloclinium'],['Cheiloclinium cognatum'],6,0,6.0 7725,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Elaeodendron balae,6092544.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Elaeodendron'],['Elaeodendron balae'],6,0,6.0 7726,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Lydenburgia cassinoides,55968.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lydenburgia'],['Lydenburgia cassinoides'],6,0,6.0 7727,1393,-1,,,,0.0,MS1_match,ZNQFUVKAKSTVGH-ANSCHSPDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-10-28(4)21(20(19)16-22(31)24(18)32)9-11-29(5)23-17-27(3,25(33)34-7)13-12-26(23,2)14-15-30(28,29)6/h8-10,16,23,31-32H,11-15,17H2,1-7H3/t23-,26-,27-,28-,29+,30-/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@@]3(C)[C@@](C)(CC=C4c5cc(O)c(O)c(C)c5C=C[C@]43C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,ZNQFUVKAKSTVGH,Terpenoids,,,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,0,6.0 7728,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-UHFFFAOYSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3",COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)C4(C)CCC3(C)C2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Celastrus monospermus,270189.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus monospermus'],6,0,6.0 7729,1393,-1,,,,0.0,MS1_match,JFACETXYABVHFD-WXPPGMDDSA-N,"InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3/t23-,26-,27-,28+,29-,30+/m1/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1,C30H40O4,pos_2_2proton,464.29265976,JFACETXYABVHFD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Acanthothamnus aphyllus,739323.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Acanthothamnus'],['Acanthothamnus aphyllus'],6,0,6.0 7730,1391,-1,,,,0.0,MS1_match,AOCLIMDHBMBYGD-NQWMYEDTSA-N,"InChI=1S/C16H28O2/c1-10-8-12(17)13-15(10,4)9-11-6-7-16(13,5)18-14(11,2)3/h10-13,17H,6-9H2,1-5H3/t10-,11-,12-,13-,15-,16+/m1/s1",C[C@@H]1C[C@@H](O)[C@@H]2[C@]1(C)C[C@H]1CC[C@]2(C)OC1(C)C,C16H28O2,pos_1_1proton1acetonitrile,252.208930136,AOCLIMDHBMBYGD,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 7731,1391,-1,,,,0.0,MS1_match,LVBXEMGDVWVTGY-VOTSOKGWSA-N,"InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h6-8H,2-5H2,1H3/b7-6+",CCCCC/C=C/C=O,C8H14O,pos_2MHCH3CN,126.104465068,LVBXEMGDVWVTGY,Fatty acids,Fatty acyls,Fatty aldehydes,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 7732,1391,-1,,,,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_2MHNH3,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 7733,1387,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.2960968,ISDB,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,2,8.18438720703125 7734,1387,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.2960968,ISDB,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,8.18438720703125 7735,1386,-1,,,,0.47763667,ISDB,FYLVGTPFZJPYES-YNZDMMAESA-N,"InChI=1S/C20H28O3/c1-12-13-4-8-19(16(12)21)9-5-14-18(2)6-3-7-20(14,15(19)10-13)11-23-17(18)22/h13-16,21H,1,3-11H2,2H3/t13-,14-,15-,16-,18-,19-,20-/m0/s1",C=C1[C@H]2CC[C@@]3(CC[C@@H]4[C@@]5(CCC[C@]4(C)C(=O)OC5)[C@H]3C2)[C@H]1O,C20H28O3,,316.203844756,FYLVGTPFZJPYES,Terpenoids,Diterpenoids,Atisane diterpenoids,Aconitum heterophyllum,124446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum heterophyllum'],6,0,7.910546660423279 7736,1385,-1,,,,0.0,MS1_match,ZYOUEEMPKPNVQW-UHFFFAOYSA-N,"InChI=1S/C13H12O4/c1-13(2)4-3-8-9(17-13)5-7-6-16-12(15)10(7)11(8)14/h3-5,14H,6H2,1-2H3",CC1(C)C=Cc2c(cc3c(c2O)C(=O)OC3)O1,C13H12O4,pos_1_1proton2acetonitrile,232.073558864,ZYOUEEMPKPNVQW,Polyketides,Cyclic polyketides,Phthalide derivatives,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,0,6.0 7737,1385,-1,,,,0.0,MS1_match,ZYOUEEMPKPNVQW-UHFFFAOYSA-N,"InChI=1S/C13H12O4/c1-13(2)4-3-8-9(17-13)5-7-6-16-12(15)10(7)11(8)14/h3-5,14H,6H2,1-2H3",CC1(C)C=Cc2c(cc3c(c2O)C(=O)OC3)O1,C13H12O4,pos_1_1proton2acetonitrile,232.073558864,ZYOUEEMPKPNVQW,Polyketides,Cyclic polyketides,Phthalide derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 7738,1377,-1,,,,0.0,MS1_match,HIJPNHPIXAZIDF-LVWPNOBMSA-N,"InChI=1S/C22H30O9/c1-27-17-8-13(5-6-16(17)25)7-15(11-23)31-20(12-24)22(30-4)14-9-18(28-2)21(26)19(10-14)29-3/h5-6,8-10,15,20,22-26H,7,11-12H2,1-4H3/t15-,20-,22-/m0/s1",COc1cc(C[C@@H](CO)O[C@@H](CO)[C@@H](OC)c2cc(OC)c(O)c(OC)c2)ccc1O,C22H30O9,pos_1_sodium,438.18898254,HIJPNHPIXAZIDF,Shikimates and Phenylpropanoids,Lignans,Neolignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 7739,1377,-1,,,,0.0,MS1_match,GGSRTZBCYWZKCQ-LVWPNOBMSA-N,"InChI=1S/C22H30O9/c1-27-17-10-14(5-6-16(17)25)22(30-4)20(12-24)31-15(11-23)7-13-8-18(28-2)21(26)19(9-13)29-3/h5-6,8-10,15,20,22-26H,7,11-12H2,1-4H3/t15-,20-,22-/m0/s1",COc1cc([C@H](OC)[C@H](CO)O[C@H](CO)Cc2cc(OC)c(O)c(OC)c2)ccc1O,C22H30O9,pos_1_sodium,438.18898254,GGSRTZBCYWZKCQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 7740,1374,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IYRMWMYZSQPJKC-UHFFFAOYSA-N,"InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H",O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O6,pos_1_1proton,286.04773804,IYRMWMYZSQPJKC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],8,3,9.5 7741,1371,-1,,,,0.95210826,ISDB,YNMFDPCLPIMRFD-KSPKLRDJSA-N,"InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15+,17-,18+,20-,21+,22+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,,596.137734816,YNMFDPCLPIMRFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Calluna vulgaris,519874.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Ericeae'],['Calluna'],['Calluna vulgaris'],4,0,7.8084330558776855 7742,1371,-1,,,,0.95210826,ISDB,YNMFDPCLPIMRFD-XTXTUNRQSA-N,"InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15+,17-,18-,20-,21+,22+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,,596.1377348159998,YNMFDPCLPIMRFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Vicia sativa,1056096.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Vicia'],['Vicia sativa'],4,0,7.8084330558776855 7743,1371,-1,,,,0.95210826,ISDB,YNMFDPCLPIMRFD-VMOLRCKHSA-N,"InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15+,17+,18+,20-,21-,22+,25+,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO[C@H]3OC[C@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,,596.1377348159999,YNMFDPCLPIMRFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Achillea collina,245242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Achillea'],['Achillea collina'],4,0,7.8084330558776855 7744,1371,-1,,,,0.95210826,ISDB,YNMFDPCLPIMRFD-WRBAWAMSSA-N,"InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15+,17+,18+,20-,21+,22-,25+,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO[C@H]3OC[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,,596.1377348159999,YNMFDPCLPIMRFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Dianthus caryophyllus,842200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Caryophylleae'],['Dianthus'],['Dianthus caryophyllus'],4,0,7.8084330558776855 7745,1371,-1,,,,0.95210826,ISDB,YNMFDPCLPIMRFD-XTXTUNRQSA-N,"InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15+,17-,18-,20-,21+,22+,25-,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,,596.1377348159998,YNMFDPCLPIMRFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Sibiraea angustata,1004734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Spiraeeae'],['Sibiraea'],['Sibiraea angustata'],4,0,7.8084330558776855 7746,1371,-1,,,,0.95210826,ISDB,YNMFDPCLPIMRFD-ZEZWPBFOSA-N,"InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15-,17+,18-,20+,21-,22-,25+,26+/m0/s1",O=c1c(O[C@H]2O[C@@H](CO[C@H]3OC[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,,596.137734816,YNMFDPCLPIMRFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Corydalis bungeana,5263529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis bungeana'],4,0,7.8084330558776855 7747,1371,-1,,,,0.95210826,ISDB,YNMFDPCLPIMRFD-ASRZSJCTSA-N,"InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15+,17+,18+,20-,21+,22+,25+,26-/m0/s1",O=c1c(O[C@@H]2O[C@H](CO[C@H]3OC[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C26H28O16,,596.137734816,YNMFDPCLPIMRFD,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Cistus ladanifer,752021.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Cistaceae'],['Unknown'],['Cistus'],['Cistus ladanifer'],4,0,7.8084330558776855 7748,1370,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,HCDXIYYTHGLFFA-TXWGWWACSA-N,"InChI=1S/C20H34O5/c1-17-8-5-9-18(2,16(23)24)13(17)6-10-19(3)14(17)7-11-20(4,25-19)15(22)12-21/h13-15,21-22H,5-12H2,1-4H3,(H,23,24)/t13-,14-,15+,17+,18+,19-,20-/m1/s1",C[C@]12CCC[C@](C)(C(=O)O)[C@@H]1CC[C@@]1(C)O[C@@](C)([C@@H](O)CO)CC[C@H]21,C20H34O5,pos_1_1proton1ammonium,354.2406241879999,HCDXIYYTHGLFFA,Terpenoids,Diterpenoids,Norlabdane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,1,6.5 7749,1369,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.6182202,ISDB,MLBWOYIGPAJIRN-UHFFFAOYSA-N,"InChI=1S/C27H47O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(29)37-18-20(28)19-38-40(35,36)39-27-25(33)23(31)22(30)24(32)26(27)34/h3-4,6-7,9-10,20,22-28,30-34H,2,5,8,11-19H2,1H3,(H,35,36)",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O,C27H47O12P,,594.2805135739998,MLBWOYIGPAJIRN,Fatty acids,Glycerophospholipids,Glycerophosphoinositols,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,6.472880840301514 7750,1368,-1,,,,0.37980577,ISDB,PHOPGVYKZWPIGA-UHFFFAOYSA-N,"InChI=1S/C11H16O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h6-7,12-13H,3-5H2,1-2H3",COc1cc(CCCO)cc(OC)c1O,C11H16O4,,212.104858992,PHOPGVYKZWPIGA,,,,Centaurea diffusa,331371.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Centaurea'],['Centaurea diffusa'],4,0,5.519223093986511 7751,1368,-1,,,,0.37980577,ISDB,PHOPGVYKZWPIGA-UHFFFAOYSA-N,"InChI=1S/C11H16O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h6-7,12-13H,3-5H2,1-2H3",COc1cc(CCCO)cc(OC)c1O,C11H16O4,,212.104858992,PHOPGVYKZWPIGA,,,,Jurinea leptoloba,5537596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Jurinea'],['Jurinea leptoloba'],4,0,5.519223093986511 7752,1368,-1,,,,0.37980577,ISDB,PHOPGVYKZWPIGA-UHFFFAOYSA-N,"InChI=1S/C11H16O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h6-7,12-13H,3-5H2,1-2H3",COc1cc(CCCO)cc(OC)c1O,C11H16O4,,212.104858992,PHOPGVYKZWPIGA,,,,Tinospora smilacina,1051363.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Burasaieae'],['Tinospora'],['Tinospora smilacina'],4,0,5.519223093986511 7753,1368,-1,,,,0.37980577,ISDB,PHOPGVYKZWPIGA-UHFFFAOYSA-N,"InChI=1S/C11H16O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h6-7,12-13H,3-5H2,1-2H3",COc1cc(CCCO)cc(OC)c1O,C11H16O4,,212.104858992,PHOPGVYKZWPIGA,,,,Helianthus annuus,515712.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Helianthus'],['Helianthus annuus'],4,0,5.519223093986511 7754,1367,-1,,,,0.0,MS1_match,UYNCCRHOWNHDMT-QFTNYOKLSA-N,"InChI=1S/C31H34O11/c1-37-23-12-18(7-8-22(23)35)28(36)27(16-34)41-31-25(39-3)13-19(14-26(31)40-4)29-21(15-33)20-10-17(6-5-9-32)11-24(38-2)30(20)42-29/h5-14,21,27-29,33-36H,15-16H2,1-4H3/b6-5+/t21-,27+,28-,29+/m1/s1",COc1cc([C@@H](O)[C@H](CO)Oc2c(OC)cc([C@@H]3Oc4c(OC)cc(/C=C/C=O)cc4[C@H]3CO)cc2OC)ccc1O,C31H34O11,pos_1_sodium,582.210111908,UYNCCRHOWNHDMT,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 7755,1367,-1,,,,0.0,MS1_match,UYNCCRHOWNHDMT-QFTNYOKLSA-N,"InChI=1S/C31H34O11/c1-37-23-12-18(7-8-22(23)35)28(36)27(16-34)41-31-25(39-3)13-19(14-26(31)40-4)29-21(15-33)20-10-17(6-5-9-32)11-24(38-2)30(20)42-29/h5-14,21,27-29,33-36H,15-16H2,1-4H3/b6-5+/t21-,27+,28-,29+/m1/s1",COc1cc([C@@H](O)[C@H](CO)Oc2c(OC)cc([C@@H]3Oc4c(OC)cc(/C=C/C=O)cc4[C@H]3CO)cc2OC)ccc1O,C31H34O11,pos_1_sodium,582.210111908,UYNCCRHOWNHDMT,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,0,7.0 7756,1367,-1,,,,0.0,MS1_match,UYNCCRHOWNHDMT-QFTNYOKLSA-N,"InChI=1S/C31H34O11/c1-37-23-12-18(7-8-22(23)35)28(36)27(16-34)41-31-25(39-3)13-19(14-26(31)40-4)29-21(15-33)20-10-17(6-5-9-32)11-24(38-2)30(20)42-29/h5-14,21,27-29,33-36H,15-16H2,1-4H3/b6-5+/t21-,27+,28-,29+/m1/s1",COc1cc([C@@H](O)[C@H](CO)Oc2c(OC)cc([C@@H]3Oc4c(OC)cc(/C=C/C=O)cc4[C@H]3CO)cc2OC)ccc1O,C31H34O11,pos_1_sodium,582.210111908,UYNCCRHOWNHDMT,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 7757,1367,-1,,,,0.0,MS1_match,UYNCCRHOWNHDMT-QFTNYOKLSA-N,"InChI=1S/C31H34O11/c1-37-23-12-18(7-8-22(23)35)28(36)27(16-34)41-31-25(39-3)13-19(14-26(31)40-4)29-21(15-33)20-10-17(6-5-9-32)11-24(38-2)30(20)42-29/h5-14,21,27-29,33-36H,15-16H2,1-4H3/b6-5+/t21-,27+,28-,29+/m1/s1",COc1cc([C@@H](O)[C@H](CO)Oc2c(OC)cc([C@@H]3Oc4c(OC)cc(/C=C/C=O)cc4[C@H]3CO)cc2OC)ccc1O,C31H34O11,pos_1_sodium,582.210111908,UYNCCRHOWNHDMT,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,0,7.0 7758,1366,917,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-NODAHLOSSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23?/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7759,1366,917,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,JGXFMIJHKASCIZ-NODAHLOSSA-N,"InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23?/m1/s1",COc1cc(-c2cc(=O)c3c(O)cc(OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc(OC)c1O,C23H24O12,pos_1_1proton1ammonium,492.1267762079998,JGXFMIJHKASCIZ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7760,1365,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.5270277,ISDB,BJFKUIUNGGPCAB-SGSCGOSXSA-N,"InChI=1S/C19H32O7/c1-10-7-12(8-19(3,4)13(10)6-5-11(2)21)25-18-17(24)16(23)15(22)14(9-20)26-18/h12,14-18,20,22-24H,5-9H2,1-4H3/t12-,14-,15-,16+,17-,18-/m1/s1",CC(=O)CCC1=C(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C19H32O7,,372.2148033639999,BJFKUIUNGGPCAB,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Epimedium grandiflorum,655264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium grandiflorum'],5,1,7.6081109046936035 7761,1365,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.5270277,ISDB,BJFKUIUNGGPCAB-VKSRGFPUSA-N,"InChI=1S/C19H32O7/c1-10-7-12(8-19(3,4)13(10)6-5-11(2)21)25-18-17(24)16(23)15(22)14(9-20)26-18/h12,14-18,20,22-24H,5-9H2,1-4H3/t12-,14-,15-,16+,17-,18+/m1/s1",CC(=O)CCC1=C(C)C[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C19H32O7,,372.2148033639999,BJFKUIUNGGPCAB,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Epimedium sagittatum,175143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium sagittatum'],5,1,7.6081109046936035 7762,1362,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.4038729,ISDB,,,,,,,QDBLJDVWLXPWOQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6154916286468506 7763,1360,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.37831292,ISDB,GEWDNTWNSAZUDX-WQMVXFAESA-N,"InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1",CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)OC,C13H20O3,,224.1412445,GEWDNTWNSAZUDX,Fatty acids,Octadecanoids,Jasmonic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,8.513251662254333 7764,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,3,7.5 7765,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,3,7.5 7766,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,3,7.5 7767,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-UHFFFAOYSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2",O=c1c(OC2OC(CO)C(O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799999,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,3,7.5 7768,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 7769,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,3,7.5 7770,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,3,7.5 7771,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,3,7.5 7772,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,3,7.5 7773,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,3,7.5 7774,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,3,7.5 7775,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lepuropetalon spathulatum,78653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lepuropetalon'],['Lepuropetalon spathulatum'],6,3,7.5 7776,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,3,7.5 7777,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 7778,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,3,7.5 7779,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,3,7.5 7780,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-UHFFFAOYSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2",O=c1c(OC2OC(CO)C(O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799999,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,3,7.5 7781,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 7782,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 7783,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DCYOADKBABEMIQ-OWMUPTOHSA-N,"InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,C21H20O12,pos_1_1proton,464.0954760799998,DCYOADKBABEMIQ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 7784,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,3,7.5 7785,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,3,7.5 7786,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,3,7.5 7787,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,3,7.5 7788,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,3,7.5 7789,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,3,7.5 7790,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia grandifolia,24239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia grandifolia'],6,3,7.5 7791,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lepuropetalon spathulatum,78653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lepuropetalon'],['Lepuropetalon spathulatum'],6,3,7.5 7792,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia caroliniana,7054807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia caroliniana'],6,3,7.5 7793,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 7794,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-IDRAQACASA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17-,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,3,7.5 7795,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,3,7.5 7796,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-UHFFFAOYSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2",O=c1c(OC2OC(CO)C(O)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799999,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Monteverdia truncata,7054806.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia truncata'],6,3,7.5 7797,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-DTGCRPNFSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.0954760799998,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 7798,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia asarifolia,363490.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia asarifolia'],6,3,7.5 7799,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia palustris,1039565.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia palustris'],6,3,7.5 7800,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia kotzebuei,913623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia kotzebuei'],6,3,7.5 7801,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia glauca,1079067.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia glauca'],6,3,7.5 7802,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Parnassia fimbriata,1035577.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Parnassia'],['Parnassia fimbriata'],6,3,7.5 7803,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lepuropetalon spathulatum,78653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Lepuropetalon'],['Lepuropetalon spathulatum'],6,3,7.5 7804,1357,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DCYOADKBABEMIQ-OWMUPTOHSA-N,"InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,C21H20O12,pos_1_1proton,464.0954760799998,DCYOADKBABEMIQ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 7805,1354,69,Terpenoids,Sesquiterpenoids,Furans,0.7228536,ISDB,JAABKYCBTCTCDQ-BOVGMKJQSA-N,"InChI=1S/C19H30O2/c1-14(2)19(20)21-13-16(4)7-6-8-17(5)18-11-9-15(3)10-12-18/h7,9,11,14,17H,6,8,10,12-13H2,1-5H3/b16-7-/t17-/m1/s1",CC1=CC=C([C@H](C)CC/C=C(/C)COC(=O)C(C)C)CC1,C19H30O2,,290.2245802,JAABKYCBTCTCDQ,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Pulicaria gnaphalodes,3899094.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pulicaria'],['Pulicaria gnaphalodes'],4,2,7.891414403915405 7806,1352,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.8834385,ISDB,WSGDYLLCHGPLOK-UDSOWZMRSA-N,"InChI=1S/C17H24O5/c1-9(19)22-15-14-12(10(6-18)7-20-15)13-11(16(13,2)3)4-5-17(14)8-21-17/h7,11-15,18H,4-6,8H2,1-3H3/t11-,12+,13-,14-,15+,17+/m0/s1",CC(=O)O[C@H]1OC=C(CO)[C@@H]2[C@@H]3[C@H](CC[C@@]4(CO4)[C@H]12)C3(C)C,C17H24O5,,308.162373868,WSGDYLLCHGPLOK,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Plagiochila yokogurensis,3855835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Jungermanniopsida'],['Jungermanniales'],['Plagiochilaceae'],['Unknown'],['Plagiochila'],['Plagiochila yokogurensis'],3,2,7.533754110336304 7807,1352,1041,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.8834385,ISDB,WSGDYLLCHGPLOK-UDSOWZMRSA-N,"InChI=1S/C17H24O5/c1-9(19)22-15-14-12(10(6-18)7-20-15)13-11(16(13,2)3)4-5-17(14)8-21-17/h7,11-15,18H,4-6,8H2,1-3H3/t11-,12+,13-,14-,15+,17+/m0/s1",CC(=O)O[C@H]1OC=C(CO)[C@@H]2[C@@H]3[C@H](CC[C@@]4(CO4)[C@H]12)C3(C)C,C17H24O5,,308.162373868,WSGDYLLCHGPLOK,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Plagiochila parvifolia,556943.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Jungermanniopsida'],['Jungermanniales'],['Plagiochilaceae'],['Unknown'],['Plagiochila'],['Plagiochila parvifolia'],3,2,7.533754110336304 7808,1348,-1,,,,0.0,MS1_match,ATFJUGCMEQBNLH-UHFFFAOYSA-N,"InChI=1S/C10H14O5/c1-10-6(12)2-4-5(3-11)9(15-10)14-8(13)7(4)10/h4-7,9,11-12H,2-3H2,1H3",CC12OC3OC(=O)C1C(CC2O)C3CO,C10H14O5,pos_2MNa,214.084123548,ATFJUGCMEQBNLH,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7809,1347,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.23128848,ISDB,JVHYYZMBYJJGJM-ZMDGZUOKSA-N,"InChI=1S/C40H54O4/c1-29(17-13-19-31(3)21-22-35(42)38(9)26-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)27-34(44-40)28-39(40,10)43/h11-24,34,43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,38-,39+,40+/m0/s1",CC(/C=C/C=C(C)/C=C/C(=O)[C@]1(C)CC(=O)CC1(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@@H](CC1(C)C)C[C@@]2(C)O,C40H54O4,,598.402210208,JVHYYZMBYJJGJM,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-κ)",Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,5.925153911113739 7810,1341,494,Alkaloids,Peptide alkaloids,Simple amide alkaloids,0.2023367,ISDB,,,,,,,KBONIIBFQNQORS,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8093467950820923 7811,1340,294,Polyketides,Cyclic polyketides,Cinnamic acids and derivatives,0.20287219,ISDB,CLTIBVYVKQWLQV-UHFFFAOYSA-N,"InChI=1S/C12H20O3/c1-10(13)6-3-2-4-7-11-8-5-9-12(14)15-11/h5,9-11,13H,2-4,6-8H2,1H3",CC(O)CCCCCC1CC=CC(=O)O1,C12H20O3,,212.1412445,CLTIBVYVKQWLQV,Polyketides,Cyclic polyketides,2-pyrone derivatives,Phleum pratense,578767.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Poeae'],['Phleum'],['Phleum pratense'],4,2,5.811488747596741 7812,1333,-1,,,,0.63994235,ISDB,BVBIFTXWPCRTEX-NRFANRHFSA-N,"InChI=1S/C21H20O6/c1-9-7-12-17(23)15-14(22)8-13-10(2)11(20(25)26-4)5-6-21(13,3)16(15)18(24)19(12)27-9/h7-8,23-24H,5-6H2,1-4H3/t21-/m0/s1",COC(=O)C1=C(C)C2=CC(=O)c3c(c(O)c4oc(C)cc4c3O)[C@@]2(C)CC1,C21H20O6,,368.12598836,BVBIFTXWPCRTEX,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Clerodendrum formicarum,6086187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum formicarum'],4,0,6.55976939201355 7813,1332,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.76793414,ISDB,QUQPHWDTPGMPEX-QJBIFVCTSA-N,"InChI=1S/C28H34O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-7,10,17,19,21-30,32-37H,8-9H2,1-2H3/t10-,17-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O,C28H34O15,,610.189770388,QUQPHWDTPGMPEX,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,10.571736574172974 7814,1330,-1,,,,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2proton2acetonitrile,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7815,1330,-1,,,,0.0,MS1_match,YFVGIJBUXMQFOF-PJOVQGMDSA-N,"InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1",COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C28H32O14,pos_2_2proton2acetonitrile,592.1792057039999,YFVGIJBUXMQFOF,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 7816,1328,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.22813672,ISDB,DMHJDKJBUGFFAY-XWILHKPASA-N,"InChI=1S/C49H59N7O13/c1-3-4-5-6-10-13-38-43(69-38)49(67)55-41-27(2)68-40(61)26-51-47(65)42(29-14-16-31(57)17-15-29)56-46(64)37(23-30-25-50-34-19-18-32(58)24-33(30)34)53-44(62)35(20-21-39(59)60)52-45(63)36(54-48(41)66)22-28-11-8-7-9-12-28/h7-9,11-12,14-19,24-25,27,35-38,41-43,50,57-58H,3-6,10,13,20-23,26H2,1-2H3,(H,51,65)(H,52,63)(H,53,62)(H,54,66)(H,55,67)(H,56,64)(H,59,60)/t27-,35+,36+,37+,38?,41+,42+,43?/m1/s1",CCCCCCCC1OC1C(=O)N[C@@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc2c[nH]c3ccc(O)cc23)C(=O)N[C@@H](c2ccc(O)cc2)C(=O)NCC(=O)O[C@@H]1C,C49H59N7O13,,953.417084948,DMHJDKJBUGFFAY,,,,Kitasatospora cystarginea,119789.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Kitasatospora'],['Kitasatospora cystarginea'],0,0,0.9125468730926514 7817,1323,-1,,,,0.0,MS1_match,FKUPPRZPSYCDRS-UHFFFAOYSA-N,InChI=1S/C15H28O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h1-14H2,O=C1CCCCCCCCCCCCCCO1,C15H28O2,pos_1_1proton1ammonium,240.208930136,FKUPPRZPSYCDRS,Fatty acids,Fatty esters,Lactones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7818,1322,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.7414075,ISDB,JDVDGNAHTZMMBI-UHFFFAOYSA-N,"InChI=1S/C21H36O3/c1-5-7-8-9-10-11-12-13-14-15-16-19-17(3)20(22)18(6-2)21(23-4)24-19/h5-16H2,1-4H3",CCCCCCCCCCCCc1oc(OC)c(CC)c(=O)c1C,C21H36O3,,336.266445012,JDVDGNAHTZMMBI,Polyketides,Cyclic polyketides,4-pyrone derivatives,Podolepis rugata,24091.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Podolepis'],['Podolepis rugata'],4,1,7.465630054473877 7819,1321,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.25285947,ISDB,JVHYYZMBYJJGJM-ZMDGZUOKSA-N,"InChI=1S/C40H54O4/c1-29(17-13-19-31(3)21-22-35(42)38(9)26-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)27-34(44-40)28-39(40,10)43/h11-24,34,43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,38-,39+,40+/m0/s1",CC(/C=C/C=C(C)/C=C/C(=O)[C@]1(C)CC(=O)CC1(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@@H](CC1(C)C)C[C@@]2(C)O,C40H54O4,,598.402210208,JVHYYZMBYJJGJM,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-κ)",Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,6.011437892913818 7820,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,3,8.5 7821,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 7822,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 7823,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,3,8.5 7824,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,3,8.5 7825,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7826,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,3,8.5 7827,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 7828,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 7829,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 7830,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,3,8.5 7831,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,3,8.5 7832,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,3,8.5 7833,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7834,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,3,8.5 7835,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7836,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 7837,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 7838,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 7839,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7840,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,3,8.5 7841,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 7842,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 7843,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 7844,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,3,8.5 7845,1316,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1potassium,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,3,8.5 7846,1315,-1,,,,0.41828722,ISDB,KTFHYOMAVCUFEY-UHFFFAOYSA-N,"InChI=1S/C19H26O/c1-18-9-5-7-14(18)17-15(8-11-18)19(2)10-4-3-6-13(19)12-16(17)20/h3,6,12,14-15,17H,4-5,7-11H2,1-2H3",CC12CCCC1C1C(=O)C=C3C=CCCC3(C)C1CC2,C19H26O,,270.198365452,KTFHYOMAVCUFEY,Terpenoids,Steroids,Androstane steroids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,5.67314887046814 7847,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,CNVZJPUDSLNTQU-SEYXRHQNSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h12-13H,2-11,14-17H2,1H3,(H,19,20)/b13-12-",CCCCCCCCCCC/C=C\CCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,CNVZJPUDSLNTQU,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 7848,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,CNVZJPUDSLNTQU-SEYXRHQNSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h12-13H,2-11,14-17H2,1H3,(H,19,20)/b13-12-",CCCCCCCCCCC/C=C\CCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,CNVZJPUDSLNTQU,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 7849,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,3,7.5 7850,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Ranunculus glacialis,225728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus glacialis'],6,3,7.5 7851,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-MDZDMXLPSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9+",CCCCCCCC/C=C/CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,7.5 7852,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-MDZDMXLPSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9+",CCCCCCCC/C=C/CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,3,7.5 7853,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 7854,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 7855,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 7856,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,ZQPPMHVWECSIRJ-KTKRTIGZSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-",CCCCCCCC/C=C\CCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,ZQPPMHVWECSIRJ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 7857,1314,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,AQWHMKSIVLSRNY-BUHFOSPRSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h13-14H,2-12,15-17H2,1H3,(H,19,20)/b14-13+",CCCCCCCCCCCC/C=C/CCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,AQWHMKSIVLSRNY,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Thalictrum simplex,243507.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum simplex'],6,3,7.5 7858,1312,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.0,MS1_match,QMPMWGJFHADPSW-SRTWBSLKSA-N,"InChI=1S/C22H33NO6/c1-4-23-9-19-13-8-21(26)18(23)22(13,14(24)6-15(19)29-19)11-5-10-12(27-2)7-20(21,25)16(11)17(10)28-3/h10-18,24-26H,4-9H2,1-3H3/t10-,11-,12+,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m1/s1",CCN1C[C@]23O[C@H]2C[C@H](O)[C@@]24[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)(C[C@H]32)[C@@H]14,C22H33NO6,pos_1_1proton,407.230787776,QMPMWGJFHADPSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,2,7.0 7859,1312,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.0,MS1_match,QMPMWGJFHADPSW-SRTWBSLKSA-N,"InChI=1S/C22H33NO6/c1-4-23-9-19-13-8-21(26)18(23)22(13,14(24)6-15(19)29-19)11-5-10-12(27-2)7-20(21,25)16(11)17(10)28-3/h10-18,24-26H,4-9H2,1-3H3/t10-,11-,12+,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m1/s1",CCN1C[C@]23O[C@H]2C[C@H](O)[C@@]24[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)(C[C@H]32)[C@@H]14,C22H33NO6,pos_1_1proton,407.230787776,QMPMWGJFHADPSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum monticola,625485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum monticola'],6,2,7.0 7860,1312,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.0,MS1_match,DQWXBKQMXDMQET-NYSGAABESA-N,"InChI=1S/C22H33NO6/c1-26-13-8-20(24)16-12(7-11(13)17(16)28-3)21-14(27-2)6-5-10-9-23-19(21)22(20,25)18(29-4)15(10)21/h9-19,24-25H,5-8H2,1-4H3/t10-,11+,12+,13-,14-,15-,16+,17-,18-,19-,20+,21-,22+/m0/s1",CO[C@H]1[C@@H]2C[C@@H]3[C@H]1[C@](O)(C[C@@H]2OC)[C@@]1(O)[C@@H](OC)[C@@H]2[C@@H]4C=N[C@H]1[C@@]23[C@@H](OC)CC4,C22H33NO6,pos_1_1proton,407.230787776,DQWXBKQMXDMQET,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,2,7.0 7861,1312,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.0,MS1_match,LRGRDKFVKMAPSZ-SWJAHKKNSA-N,"InChI=1S/C22H33NO6/c1-4-23-9-19(24)6-5-13-21-12(19)7-10(17(21)23)20(25)8-11(27-2)14-15(29-13)16(21)22(20,26)18(14)28-3/h10-18,24-26H,4-9H2,1-3H3/t10-,11-,12+,13-,14-,15+,16-,17+,18-,19+,20-,21+,22-/m0/s1",CCN1C[C@]2(O)CC[C@@H]3O[C@@H]4[C@@H]5[C@@H](OC)C[C@]6(O)[C@H]7C[C@H]2[C@]3([C@@H]71)[C@H]4[C@]6(O)[C@H]5OC,C22H33NO6,pos_1_1proton,407.230787776,LRGRDKFVKMAPSZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,2,7.0 7862,1312,477,Polyketides,Pseudoalkaloids,Acyl phloroglucinols,0.0,MS1_match,XGNLVYXRWSQUKE-PGFKDEHDSA-N,"InChI=1S/C22H33NO6/c1-27-9-20-5-4-15(29-3)22-11-6-10-13(28-2)8-21(26,16(11)17(10)24)12(7-14(20)22)18(22)23-19(20)25/h10-18,24,26H,4-9H2,1-3H3,(H,23,25)/t10-,11-,12+,13+,14-,15+,16-,17-,18-,20+,21+,22-/m1/s1",COC[C@@]12CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]13)[C@H]4NC2=O,C22H33NO6,pos_1_1proton,407.230787776,XGNLVYXRWSQUKE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,2,7.0 7863,1311,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,OOUTWVMJGMVRQF-NWYYEFBESA-N,"InChI=1S/C40H52O3/c1-28(17-13-19-30(3)21-23-34-32(5)36(41)25-26-39(34,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-35-33(6)38(43)37(42)27-40(35,9)10/h11-24,37,42H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t37-/m0/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)[C@@H](O)CC2(C)C)C(C)(C)CCC1=O,C40H52O3,pos_1_1proton1methanol,580.391645524,OOUTWVMJGMVRQF,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Adonis annua,804994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis annua'],6,3,7.5 7864,1308,-1,,,,0.21366908,ISDB,,,,,,,IBUKXRINTKQBRQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8546763062477112 7865,1307,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.31928253,ISDB,NXIXBHMKUKUWCV-VSGBNLITSA-N,"InChI=1S/C29H36O/c1-23(2)10-9-15-26-17-20-28(29(30)21-18-25-13-7-4-8-14-25)27(22-26)19-16-24-11-5-3-6-12-24/h3-8,10-14,17,27-28H,9,15-16,18-22H2,1-2H3/t27-,28-/m1/s1",CC(C)=CCCC1=CC[C@@H](C(=O)CCc2ccccc2)[C@H](CCc2ccccc2)C1,C29H36O,,400.276615772,NXIXBHMKUKUWCV,Terpenoids,,,Alpinia officinarum,477388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Alpinia'],['Alpinia officinarum'],4,1,5.777130126953125 7866,1306,636,Polyketides,Aromatic polyketides,Catechols with side chains,0.3153726,ISDB,FGPOGAUCGOZVPS-XBLVEGMJSA-N,"InChI=1S/C18H26O/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(19)16-14-17/h7-10,13-16,19H,2-6,11-12H2,1H3/b8-7+,10-9+",CCCCCC/C=C/C=C/CCc1ccc(O)cc1,C18H26O,,258.198365452,FGPOGAUCGOZVPS,Polyketides,Aromatic polyketides,Catechols with side chains,Piper villiramulum,865488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper villiramulum'],4,3,6.761490345001221 7867,1303,-1,,,,0.42658973,ISDB,UPACPHKOSSOYIY-NEIIXNPVSA-N,"InChI=1S/C32H50O3/c1-21(34)35-26-12-13-29(6)24(28(26,4)5)11-14-31(8)25(29)10-9-22-23-19-27(2,3)15-17-32(23,20-33)18-16-30(22,31)7/h9,20,23-26H,10-19H2,1-8H3/t23-,24-,25+,26-,29-,30+,31+,32+/m0/s1",CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC=C4[C@@H]5CC(C)(C)CC[C@]5(C=O)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C,C32H50O3,,482.37599546,UPACPHKOSSOYIY,Terpenoids,Triterpenoids,Oleanane triterpenoids,Euptelea polyandra,971328.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Eupteleaceae'],['Unknown'],['Euptelea'],['Euptelea polyandra'],5,0,6.706358909606934 7868,1302,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.7117334,ISDB,JDVDGNAHTZMMBI-UHFFFAOYSA-N,"InChI=1S/C21H36O3/c1-5-7-8-9-10-11-12-13-14-15-16-19-17(3)20(22)18(6-2)21(23-4)24-19/h5-16H2,1-4H3",CCCCCCCCCCCCc1oc(OC)c(CC)c(=O)c1C,C21H36O3,,336.266445012,JDVDGNAHTZMMBI,Polyketides,Cyclic polyketides,4-pyrone derivatives,Podolepis rugata,24091.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Podolepis'],['Podolepis rugata'],4,1,7.346933603286743 7869,1299,-1,,,,0.79631346,ISDB,QFIHQWXKTUONPL-UHFFFAOYSA-N,"InChI=1S/C18H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h14-17H,2-13H2,1H3,(H2,19,20)",CCCCCCCCCCCCCC=CC=CC(N)=O,C18H33NO,,279.256214676,QFIHQWXKTUONPL,,,,Piper longum,97780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper longum'],4,0,7.185253858566284 7870,1292,109,Terpenoids,Diterpenoids,Estrane steroids,0.21918379,ISDB,SXCVPGXYCJAUPB-YLAKUSLOSA-N,"InChI=1S/C20H32O3/c1-13(2)15-7-8-20(6)11-16(9-14(3)17(20)10-15)23-18(21)12-19(4,5)22/h15-17,22H,1,3,7-12H2,2,4-6H3/t15-,16+,17+,20+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](OC(=O)CC(C)(C)O)CC(=C)[C@@H]2C1,C20H32O3,,320.235144884,SXCVPGXYCJAUPB,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,7.376735150814056 7871,1289,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.8001274,ISDB,BXBVPYSHEOQGHP-UHFFFAOYSA-N,"InChI=1S/C17H26O4/c1-13(2)7-5-4-6-8-17(19)21-12-14-9-10-15(18)16(11-14)20-3/h9-11,13,18H,4-8,12H2,1-3H3",COc1cc(COC(=O)CCCCCC(C)C)ccc1O,C17H26O4,,294.183109312,BXBVPYSHEOQGHP,Alkaloids,Pseudoalkaloids,Capsaicins and Capsaicinoids,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,0,7.200509548187256 7872,1288,18,Terpenoids,Diterpenoids,Halimane diterpenoids,0.33748809,ISDB,BOUHSOCEHRQJNM-UHFFFAOYSA-N,"InChI=1S/C26H41N5/c1-18(12-15-31-17-30(6)24-22(31)23(27)28-16-29-24)11-14-26(5)19(2)9-10-20-21(26)8-7-13-25(20,3)4/h8,12,16,19-20H,7,9-11,13-15,17H2,1-6H3,(H2,27,28,29)",CC(=CCN1CN(C)c2ncnc(N)c21)CCC1(C)C2=CCCC(C)(C)C2CCC1C,C26H41N5,,423.336196312,BOUHSOCEHRQJNM,Terpenoids,Diterpenoids,Halimane diterpenoids,Agelas mauritiana,789573.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Agelasida'],['Agelasidae'],['Unknown'],['Agelas'],['Agelas mauritiana'],1,3,3.8499523401260376 7873,1288,18,Terpenoids,Diterpenoids,Halimane diterpenoids,0.33748809,ISDB,BOUHSOCEHRQJNM-UHFFFAOYSA-N,"InChI=1S/C26H41N5/c1-18(12-15-31-17-30(6)24-22(31)23(27)28-16-29-24)11-14-26(5)19(2)9-10-20-21(26)8-7-13-25(20,3)4/h8,12,16,19-20H,7,9-11,13-15,17H2,1-6H3,(H2,27,28,29)",CC(=CCN1CN(C)c2ncnc(N)c21)CCC1(C)C2=CCCC(C)(C)C2CCC1C,C26H41N5,,423.336196312,BOUHSOCEHRQJNM,Terpenoids,Diterpenoids,Halimane diterpenoids,Agelas nakamurai,828033.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Agelasida'],['Agelasidae'],['Unknown'],['Agelas'],['Agelas nakamurai'],1,3,3.8499523401260376 7874,1286,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.37494045,ISDB,OARNNVHEVHXYOP-IKYWDFKNSA-N,"InChI=1S/C42H66O12/c1-22(2)23(3)17-34(44)53-33-21-32-39(7)14-12-28(18-27(39)11-15-41(32,46)42(47)16-13-29(24(4)43)40(33,42)8)52-35-20-31(49-10)38(26(6)51-35)54-36-19-30(48-9)37(45)25(5)50-36/h11,17,22,25-26,28-33,35-38,45-47H,12-16,18-21H2,1-10H3/b23-17+/t25-,26-,28+,29+,30+,31+,32-,33-,35+,36+,37-,38-,39+,40+,41+,42-/m1/s1",CO[C@H]1C[C@H](O[C@H]2[C@@H](OC)C[C@H](O[C@H]3CC[C@@]4(C)C(=CC[C@]5(O)[C@@H]4C[C@@H](OC(=O)/C=C(\C)C(C)C)[C@]4(C)[C@H](C(C)=O)CC[C@@]45O)C3)O[C@@H]2C)O[C@H](C)[C@H]1O,C42H66O12,,762.455427552,OARNNVHEVHXYOP,Terpenoids,Steroids,Pregnane steroids,Cynanchum boudieri,727538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Cynanchum'],['Cynanchum boudieri'],4,1,5.9997618198394775 7875,1286,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.37494045,ISDB,OARNNVHEVHXYOP-IKYWDFKNSA-N,"InChI=1S/C42H66O12/c1-22(2)23(3)17-34(44)53-33-21-32-39(7)14-12-28(18-27(39)11-15-41(32,46)42(47)16-13-29(24(4)43)40(33,42)8)52-35-20-31(49-10)38(26(6)51-35)54-36-19-30(48-9)37(45)25(5)50-36/h11,17,22,25-26,28-33,35-38,45-47H,12-16,18-21H2,1-10H3/b23-17+/t25-,26-,28+,29+,30+,31+,32-,33-,35+,36+,37-,38-,39+,40+,41+,42-/m1/s1",CO[C@H]1C[C@H](O[C@H]2[C@@H](OC)C[C@H](O[C@H]3CC[C@@]4(C)C(=CC[C@]5(O)[C@@H]4C[C@@H](OC(=O)/C=C(\C)C(C)C)[C@]4(C)[C@H](C(C)=O)CC[C@@]45O)C3)O[C@@H]2C)O[C@H](C)[C@H]1O,C42H66O12,,762.455427552,OARNNVHEVHXYOP,Terpenoids,Steroids,Pregnane steroids,Cynanchum caudatum,727549.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Cynanchum'],['Cynanchum caudatum'],4,1,5.9997618198394775 7876,1286,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.37494045,ISDB,OARNNVHEVHXYOP-IKYWDFKNSA-N,"InChI=1S/C42H66O12/c1-22(2)23(3)17-34(44)53-33-21-32-39(7)14-12-28(18-27(39)11-15-41(32,46)42(47)16-13-29(24(4)43)40(33,42)8)52-35-20-31(49-10)38(26(6)51-35)54-36-19-30(48-9)37(45)25(5)50-36/h11,17,22,25-26,28-33,35-38,45-47H,12-16,18-21H2,1-10H3/b23-17+/t25-,26-,28+,29+,30+,31+,32-,33-,35+,36+,37-,38-,39+,40+,41+,42-/m1/s1",CO[C@H]1C[C@H](O[C@H]2[C@@H](OC)C[C@H](O[C@H]3CC[C@@]4(C)C(=CC[C@]5(O)[C@@H]4C[C@@H](OC(=O)/C=C(\C)C(C)C)[C@]4(C)[C@H](C(C)=O)CC[C@@]45O)C3)O[C@@H]2C)O[C@H](C)[C@H]1O,C42H66O12,,762.455427552,OARNNVHEVHXYOP,Terpenoids,Steroids,Pregnane steroids,Orthosia guilleminiana,727549.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Apocynaceae'],['Asclepiadeae'],['Cynanchum'],['Cynanchum caudatum'],4,1,5.9997618198394775 7877,1285,1035,Terpenoids,Diterpenoids,Noreremophilane sesquiterpenoids,0.23877215,ISDB,UGDVDUDNGSZKIS-HRVVTOCWSA-N,"InChI=1S/C29H38O3/c1-16-9-7-11-21-13-25-27(18(3)26(16)21)19(4)28(32-25)31-24-14-22-12-8-10-17(2)29(22,6)15-23(24)20(5)30/h13,16-17,22H,7-12,14-15H2,1-6H3/t16-,17-,22+,29+/m0/s1",CC(=O)C1=C(Oc2oc3cc4c(c(C)c3c2C)[C@@H](C)CCC4)C[C@H]2CCC[C@H](C)[C@@]2(C)C1,C29H38O3,,434.282095076,UGDVDUDNGSZKIS,Terpenoids,Sesquiterpenoids,Noreremophilane sesquiterpenoids,Ligularia muliensis,7051955.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia muliensis'],4,3,6.4550886154174805 7878,1284,-1,,,,0.6068234,ISDB,FGFHNMBIMRVWIW-FQBABPJXSA-N,"InChI=1S/C39H62O6/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-31(40)44-34-26(2)24-38-27(3)22-30-32(36(30,4)5)29(33(38)41)23-28-25-43-37(6,7)45-35(28)39(34,38)42/h23-24,27,29-30,32,34-35,42H,8-22,25H2,1-7H3/t27-,29+,30-,32+,34+,35-,38+,39-/m1/s1",CCCCCCCCCCCCCCCC(=O)O[C@H]1C(C)=C[C@]23C(=O)[C@@H](C=C4COC(C)(C)O[C@H]4[C@]12O)[C@H]1[C@@H](C[C@H]3C)C1(C)C,C39H62O6,,626.454639704,FGFHNMBIMRVWIW,Terpenoids,Diterpenoids,Ingenane diterpenoids,Euphorbia ebracteolata,591082.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Euphorbieae'],['Euphorbia'],['Euphorbia ebracteolata'],4,0,6.427293539047241 7879,1283,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7576129,ISDB,KBGYPXOSNDMZRV-IUQGRGSQSA-N,"InChI=1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,6-7,9-10H,2,5,8,11-15H2,1H3,(H,17,18)/b4-3+,7-6+,10-9+",CC/C=C/C/C=C/C/C=C/CCCCCC(=O)O,C16H26O2,,250.193280072,KBGYPXOSNDMZRV,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Brassica napus,309234.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica napus'],4,3,8.530451536178589 7880,1283,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7576129,ISDB,KBGYPXOSNDMZRV-UHFFFAOYSA-N,"InChI=1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,6-7,9-10H,2,5,8,11-15H2,1H3,(H,17,18)",CCC=CCC=CCC=CCCCCCC(=O)O,C16H26O2,,250.193280072,KBGYPXOSNDMZRV,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Apium graveolens,2472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,3,8.530451536178589 7881,1282,-1,,,,0.34202263,ISDB,GIZSHQYTTBQKOQ-OIBJUYFYSA-N,"InChI=1S/C11H16O6/c1-16-8-3-6(10(14)7(13)5-12)4-9(17-2)11(8)15/h3-4,7,10,12-15H,5H2,1-2H3/t7-,10+/m0/s1",COc1cc([C@@H](O)[C@@H](O)CO)cc(OC)c1O,C11H16O6,,244.094688232,GIZSHQYTTBQKOQ,Shikimates and Phenylpropanoids,Lignans,Minor lignans,Kandelia candel,973786.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Rhizophoraceae'],['Unknown'],['Kandelia'],['Kandelia candel'],4,0,5.368090510368347 7882,1282,-1,,,,0.34202263,ISDB,GIZSHQYTTBQKOQ-GMSGAONNSA-N,"InChI=1S/C11H16O6/c1-16-8-3-6(10(14)7(13)5-12)4-9(17-2)11(8)15/h3-4,7,10,12-15H,5H2,1-2H3/t7-,10-/m1/s1",COc1cc([C@@H](O)[C@H](O)CO)cc(OC)c1O,C11H16O6,,244.094688232,GIZSHQYTTBQKOQ,Shikimates and Phenylpropanoids,Lignans,Minor lignans,Magnolia grandiflora,622553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Magnoliaceae'],['Unknown'],['Magnolia'],['Magnolia grandiflora'],4,0,5.368090510368347 7883,1282,-1,,,,0.34202263,ISDB,GIZSHQYTTBQKOQ-XVKPBYJWSA-N,"InChI=1S/C11H16O6/c1-16-8-3-6(10(14)7(13)5-12)4-9(17-2)11(8)15/h3-4,7,10,12-15H,5H2,1-2H3/t7-,10-/m0/s1",COc1cc([C@H](O)[C@@H](O)CO)cc(OC)c1O,C11H16O6,,244.094688232,GIZSHQYTTBQKOQ,Shikimates and Phenylpropanoids,Lignans,Minor lignans,Coix lacryma-jobi,83448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Andropogoneae'],['Coix'],['Coix lacryma-jobi'],4,0,5.368090510368347 7884,1281,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,AZUURFWEIQDHCN-MZGJNUFDSA-N,"InChI=1S/C40H44O22/c1-14-25(46)29(50)31(52)38(55-14)56-17-10-20(45)24-21(11-17)57-33(16-7-8-18(43)19(44)9-16)35(28(24)49)61-40-36(30(51)26(47)22(12-41)59-40)62-39-32(53)34(27(48)23(13-42)58-39)60-37(54)15-5-3-2-4-6-15/h2-11,14,22-23,25-27,29-32,34,36,38-48,50-53H,12-13H2,1H3/t14-,22+,23+,25-,26+,27+,29+,30-,31+,32+,34-,36+,38+,39-,40-/m1/s1",C[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](OC(=O)c5ccccc5)[C@@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C40H44O22,pos_2_2proton,876.232423048,AZUURFWEIQDHCN,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium carolinianum,529153.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium carolinianum'],6,1,6.5 7885,1278,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,DARGUPSDBIBHDD-SNVBAGLBSA-N,"InChI=1S/C12H16O3/c1-5-10(13-2)9-6-7-11(14-3)12(8-9)15-4/h5-8,10H,1H2,2-4H3/t10-/m1/s1",C=C[C@@H](OC)c1ccc(OC)c(OC)c1,C12H16O3,pos_1_1proton,208.109944372,DARGUPSDBIBHDD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,3,7.5 7886,1276,-1,,,,0.27950457,ISDB,LYEFFNNYUIQXHS-YHWKNFMLSA-N,"InChI=1S/C16H22O3/c1-12(2)5-4-9-16(3,19)10-8-13-11-14(17)6-7-15(13)18/h5-8,10-11,17-19H,4,9H2,1-3H3/b10-8-/t16-/m0/s1",CC(C)=CCC[C@](C)(O)/C=C\c1cc(O)ccc1O,C16H22O3,,262.156894564,LYEFFNNYUIQXHS,Terpenoids,Meroterpenoids,Meromonoterpenoids,Cordia alliodora,638295.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Cordiaceae'],['Unknown'],['Cordia'],['Cordia alliodora'],0,0,1.1180182695388794 7887,1275,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,KBPHJBAIARWVSC-RGZFRNHPSA-N,"InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36+,37-/m0/s1",CC1=C[C@H](O)CC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C,C40H56O2,pos_1_1sodium1acetonitrile,568.4280310319999,KBPHJBAIARWVSC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-ε)",Ranunculus acris,387818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus acris'],6,2,7.0 7888,1275,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,KBPHJBAIARWVSC-IRHPOQNPSA-N,"InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-,37+/m1/s1",CC1=C[C@@H](O)CC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C,C40H56O2,pos_1_1sodium1acetonitrile,568.4280310319999,KBPHJBAIARWVSC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-ε)",Caltha palustris,387810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Caltheae'],['Caltha'],['Caltha palustris'],6,2,7.0 7889,1275,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,KBPHJBAIARWVSC-UHFFFAOYSA-N,"InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3",CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1C(C)=CC(O)CC1(C)C,C40H56O2,pos_1_1sodium1acetonitrile,568.4280310319999,KBPHJBAIARWVSC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-ε)",Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,2,7.0 7890,1275,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,KBPHJBAIARWVSC-RGZFRNHPSA-N,"InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36+,37-/m0/s1",CC1=C[C@H](O)CC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C,C40H56O2,pos_1_1sodium1acetonitrile,568.4280310319999,KBPHJBAIARWVSC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-ε)",Ranunculus acris,387818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus acris'],6,2,7.0 7891,1275,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,KBPHJBAIARWVSC-IRHPOQNPSA-N,"InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-,37+/m1/s1",CC1=C[C@@H](O)CC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C,C40H56O2,pos_1_1sodium1acetonitrile,568.4280310319999,KBPHJBAIARWVSC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-ε)",Caltha palustris,387810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Caltheae'],['Caltha'],['Caltha palustris'],6,2,7.0 7892,1275,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.0,MS1_match,KBPHJBAIARWVSC-UHFFFAOYSA-N,"InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-25,35-37,41-42H,26-28H2,1-10H3",CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1C(C)=CC(O)CC1(C)C,C40H56O2,pos_1_1sodium1acetonitrile,568.4280310319999,KBPHJBAIARWVSC,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-ε)",Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,2,7.0 7893,1272,355,Terpenoids,Monoterpenoids,Simple phenolic acids,0.0,MS1_match,QPJVMBTYPHYUOC-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3",COC(=O)c1ccccc1,C8H8O2,pos_1_1proton1methanol,136.052429496,QPJVMBTYPHYUOC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 7894,1268,-1,,,,0.6708951,ISDB,BSQFXUQGLXURQM-NJAFHUGGSA-N,"InChI=1S/C18H24O3/c1-11-8-12-4-5-15-16(2,3)18(20)7-6-17(15,10-21-18)13(12)9-14(11)19/h8-9,15,19-20H,4-7,10H2,1-3H3/t15-,17+,18+/m1/s1",Cc1cc2c(cc1O)[C@]13CC[C@](O)(OC1)C(C)(C)[C@H]3CC2,C18H24O3,,288.172544628,BSQFXUQGLXURQM,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Micrandropsis scleroxylon,603561.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Micrandreae'],['Micrandropsis'],['Micrandropsis scleroxylon'],4,0,6.68358039855957 7895,1267,967,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2806678,ISDB,SVHAKFJIIYNECQ-UNMGPXMVSA-N,"InChI=1S/C29H48O4/c1-24(2)11-13-29(16-24)14-12-27(5)18(22(29)32)7-8-21-25(3)15-19(31)23(33)26(4,17-30)20(25)9-10-28(21,27)6/h7,19-23,30-33H,8-17H2,1-6H3/t19-,20-,21-,22-,23+,25+,26+,27-,28-,29+/m1/s1",CC1(C)CC[C@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@H]2O)C1,C29H48O4,,460.355260016,SVHAKFJIIYNECQ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Phlomoides umbrosa,7054124.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Phlomideae'],['Phlomoides'],['Phlomoides umbrosa'],4,3,6.6226712465286255 7896,1264,69,Terpenoids,Sesquiterpenoids,Furans,0.6290321,ISDB,CMOBMIROEGHAAS-KEBGGAJQSA-N,"InChI=1S/C20H34O3/c1-16(2)11-12-20(23)19(15-22)10-6-9-17(3)7-5-8-18(4)13-14-21/h7,10-11,13,20-23H,5-6,8-9,12,14-15H2,1-4H3/b17-7+,18-13+,19-10+/t20-/m1/s1",CC(C)=CC[C@@H](O)/C(=C/CC/C(C)=C/CC/C(C)=C/CO)CO,C20H34O3,,322.250794948,CMOBMIROEGHAAS,Terpenoids,Diterpenoids,,Zinnia peruviana,378511.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Zinnia'],['Zinnia peruviana'],4,1,7.016128301620483 7897,1259,758,Carbohydrates,Saccharides,Humulane sesquiterpenoids,0.56542957,ISDB,ZWLXFBYSDMETNJ-FPJLUQMPSA-N,"InChI=1S/C25H32O2/c1-20-7-5-8-23(9-6-17-25(3,4)18-16-20)19-27-24(26)15-14-22-12-10-21(2)11-13-22/h6,8,10-17H,5,7,9,18-19H2,1-4H3/b15-14-,17-6+,20-16+,23-8-",C/C1=C\CC(C)(C)/C=C/C/C(COC(=O)/C=C\c2ccc(C)cc2)=C/CC1,C25H32O2,,364.240230264,ZWLXFBYSDMETNJ,Terpenoids,Sesquiterpenoids,Humulane sesquiterpenoids,Betula pendula,267719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Betulaceae'],['Unknown'],['Betula'],['Betula pendula'],4,3,7.761718273162842 7898,1256,391,Alkaloids,Ornithine alkaloids,Polyamines,0.55563307,ISDB,JIRJLWLQLDLWSW-XNDBBLGPSA-N,"InChI=1S/C25H47N3O/c1-19-10-11-21-24(3)22(20-18-25(19,21)13-12-23(20,2)29-24)26-14-7-8-16-28(6)17-9-15-27(4)5/h19-22,26H,7-18H2,1-6H3/t19-,20-,21-,22+,23-,24+,25+/m1/s1",C[C@@H]1CC[C@H]2[C@]13CC[C@@]1(C)O[C@]2(C)[C@@H](NCCCCN(C)CCCN(C)C)[C@H]1C3,C25H47N3O,,405.371913124,JIRJLWLQLDLWSW,Alkaloids,Pseudoalkaloids,,Chaetosphaeronema hispidulum,1049011.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Dothideomycetes'],['Pleosporales'],['Phaeosphaeriaceae'],['Unknown'],['Chaetosphaeronema'],['Chaetosphaeronema hispidulum'],1,1,3.722532272338867 7899,1255,-1,,,,0.39465997,ISDB,RLICNSMALRTYLN-UHFFFAOYSA-N,"InChI=1S/C37H64O6/c1-3-4-5-16-20-31(38)21-18-23-33(39)34-26-27-36(43-34)35-25-24-32(42-35)22-17-14-12-10-8-6-7-9-11-13-15-19-30-28-29(2)41-37(30)40/h28-29,32-36,39H,3-27H2,1-2H3",CCCCCCC(=O)CCCC(O)C1CCC(C2CCC(CCCCCCCCCCCCCC3=CC(C)OC3=O)O2)O1,C37H64O6,,604.470289768,RLICNSMALRTYLN,Polyketides,Linear polyketides,Acetogenins,Uvaria narum,3867752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Uvaria'],['Uvaria narum'],4,0,5.57863986492157 7900,1255,-1,,,,0.39465997,ISDB,RLICNSMALRTYLN-UHFFFAOYSA-N,"InChI=1S/C37H64O6/c1-3-4-5-16-20-31(38)21-18-23-33(39)34-26-27-36(43-34)35-25-24-32(42-35)22-17-14-12-10-8-6-7-9-11-13-15-19-30-28-29(2)41-37(30)40/h28-29,32-36,39H,3-27H2,1-2H3",CCCCCCC(=O)CCCC(O)C1CCC(C2CCC(CCCCCCCCCCCCCC3=CC(C)OC3=O)O2)O1,C37H64O6,,604.470289768,RLICNSMALRTYLN,Polyketides,Linear polyketides,Acetogenins,Uvaria concava,292799.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Uvaria'],['Uvaria concava'],4,0,5.57863986492157 7901,1255,-1,,,,0.39465997,ISDB,RLICNSMALRTYLN-UHFFFAOYSA-N,"InChI=1S/C37H64O6/c1-3-4-5-16-20-31(38)21-18-23-33(39)34-26-27-36(43-34)35-25-24-32(42-35)22-17-14-12-10-8-6-7-9-11-13-15-19-30-28-29(2)41-37(30)40/h28-29,32-36,39H,3-27H2,1-2H3",CCCCCCC(=O)CCCC(O)C1CCC(C2CCC(CCCCCCCCCCCCCC3=CC(C)OC3=O)O2)O1,C37H64O6,,604.470289768,RLICNSMALRTYLN,Polyketides,Linear polyketides,Acetogenins,Uvaria hookeri,3867838.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Uvaria'],['Uvaria hookeri'],4,0,5.57863986492157 7902,1253,69,Terpenoids,Sesquiterpenoids,Furans,0.49435267,ISDB,BLNDDYNVUIBQFL-KSQKUNDXSA-N,"InChI=1S/C19H32O3/c1-3-4-5-6-8-11-14-17-22-18-15-12-9-7-10-13-16-19(20)21-2/h8,11,14-15,17-18H,3-7,9-10,12-13,16H2,1-2H3/b11-8-,17-14+,18-15+",CCCCC/C=C\C=C\O/C=C/CCCCCCC(=O)OC,C19H32O3,,308.235144884,BLNDDYNVUIBQFL,Fatty acids,Fatty acyls,Fatty ethers,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,0,5.977410674095154 7903,1251,-1,,,,0.0,MS1_match,FMRHJJZUHUTGKE-UHFFFAOYSA-N,"InChI=1S/C15H22O3/c1-3-5-8-12(4-2)11-18-15(17)13-9-6-7-10-14(13)16/h6-7,9-10,12,16H,3-5,8,11H2,1-2H3",CCCCC(CC)COC(=O)c1ccccc1O,C15H22O3,pos_1_1proton,250.156894564,FMRHJJZUHUTGKE,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 7904,1245,-1,,,,0.0,MS1_match,PTANMXMDKJWUPQ-GUXIHRGDSA-N,"InChI=1S/C26H43NO8/c1-7-27-12-22(13-31-2)9-8-16(33-4)25-19(22)20(35-6)26(30,21(25)27)24(29)11-15(32-3)14-10-23(25,28)18(24)17(14)34-5/h14-21,28-30H,7-13H2,1-6H3/t14-,15+,16+,17+,18+,19-,20+,21+,22+,23+,24-,25-,26-/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC,C26H43NO8,pos_2_2proton1ammonium,497.298867336,PTANMXMDKJWUPQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium,518366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Unknown'],6,0,6.0 7905,1243,-1,,,,0.5798264,ISDB,KIGOXANJBVQEHO-VZPOVYNMSA-N,"InChI=1S/C29H48/c1-19-12-15-26(4)17-18-28(6)23(25(26)21(19)3)10-11-24-27(5)14-8-9-20(2)22(27)13-16-29(24,28)7/h10,19-22,24-25H,8-9,11-18H2,1-7H3/t19-,20-,21+,22+,24-,25+,26-,27+,28-,29-/m1/s1",C[C@H]1[C@H](C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC[C@@H](C)[C@@H]5CC[C@]43C)[C@H]12,C29H48,,396.375601536,KIGOXANJBVQEHO,Terpenoids,Triterpenoids,Ursane and Taraxastane triterpenoids,Haloxylon salicornicum,499681.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Salsoleae'],['Haloxylon'],['Haloxylon salicornicum'],4,0,6.319305658340454 7906,1242,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.48628646,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Guapira graciliflora,6038299.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Nyctaginaceae'],['Unknown'],['Guapira'],['Guapira graciliflora'],4,2,6.945145845413208 7907,1242,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.48628646,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Zingiber officinale,1063866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Zingiber'],['Zingiber officinale'],4,2,6.945145845413208 7908,1242,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.48628646,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Sonchus arvensis,761934.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus arvensis'],4,2,6.945145845413208 7909,1242,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.48628646,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Sonchus mauritanicus,572923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus mauritanicus'],4,2,6.945145845413208 7910,1242,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.48628646,ISDB,MPSGDHOYFIUPSO-MDAKJLGTSA-N,"InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23-,24-,26+,27+,28+,29+,30-,31-,32-,33+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H56O14,,676.367006472,MPSGDHOYFIUPSO,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Premna microphylla,503286.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Premna'],['Premna microphylla'],4,2,6.945145845413208 7911,1240,-1,,,,0.23960963,ISDB,,,,,,,LXFXYUDXDUHBIA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.958438515663147 7912,1239,69,Terpenoids,Sesquiterpenoids,Furans,0.58687073,ISDB,CTLVRIOTFRWXKP-BGTYHANMSA-N,"InChI=1S/C18H28O/c1-13-7-6-8-16-17(13,4)11-9-14(2)18(16,5)12-10-15(3)19/h6-7,14,16H,1,8-12H2,2-5H3/t14-,16-,17+,18+/m1/s1",C=C1C=CC[C@H]2[C@@](C)(CCC(C)=O)[C@H](C)CC[C@@]12C,C18H28O,,260.214015516,CTLVRIOTFRWXKP,Terpenoids,Sesquiterpenoids,,Parentucellia latifolia,981066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Rhinantheae'],['Parentucellia'],['Parentucellia latifolia'],4,2,7.347482919692993 7913,1238,784,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,0.30738306,ISDB,WSPSBGYYAVPUDE-HZJYTTRNSA-N,"InChI=1S/C23H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(26)20(24)18-21(25)23(19)27/h6-7,9-10,18,24,27H,2-5,8,11-17H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC1=C(O)C(=O)C=C(O)C1=O,C23H34O4,,374.245709568,WSPSBGYYAVPUDE,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,Embelia angustifolia,6052001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Embelia'],['Embelia angustifolia'],4,3,6.729532241821289 7914,1237,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.7839282,ISDB,LCDDKECOTQQPAO-UHFFFAOYSA-N,"InChI=1S/C22H40O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h3-4,6-7,9-10,23H,2,5,8,11-22H2,1H3",CCC=CCC=CCC=CCCCCCCCCCCCCO,C22H40O,,320.30791589999995,LCDDKECOTQQPAO,Fatty acids,Fatty acyls,Fatty alcohols,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],0,1,3.6357128620147705 7915,1233,-1,,,,0.0,MS1_match,BNBCNSZOUCPLOA-YLJYHZDGSA-N,"InChI=1S/C20H18O9/c21-14-6-1-12(2-7-14)5-10-16(23)29-17(18(24)25)20(28,19(26)27)11-13-3-8-15(22)9-4-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/t17-,20-/m1/s1",O=C(C=Cc1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O9,pos_1_1proton,402.095082156,BNBCNSZOUCPLOA,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 7916,1233,-1,,,,0.0,MS1_match,BNBCNSZOUCPLOA-YLJYHZDGSA-N,"InChI=1S/C20H18O9/c21-14-6-1-12(2-7-14)5-10-16(23)29-17(18(24)25)20(28,19(26)27)11-13-3-8-15(22)9-4-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/t17-,20-/m1/s1",O=C(C=Cc1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O9,pos_1_1proton,402.095082156,BNBCNSZOUCPLOA,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 7917,1233,-1,,,,0.0,MS1_match,BNBCNSZOUCPLOA-YLJYHZDGSA-N,"InChI=1S/C20H18O9/c21-14-6-1-12(2-7-14)5-10-16(23)29-17(18(24)25)20(28,19(26)27)11-13-3-8-15(22)9-4-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/t17-,20-/m1/s1",O=C(C=Cc1ccc(O)cc1)O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C20H18O9,pos_1_1proton,402.095082156,BNBCNSZOUCPLOA,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 7918,1233,-1,,,,0.0,MS1_match,RHQXHDXIEARXSC-DTLVDHMJSA-N,"InChI=1S/C20H18O9/c21-14-8-6-12(10-15(14)22)7-9-16(23)29-17(18(24)25)20(28,19(26)27)11-13-4-2-1-3-5-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/b9-7+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccccc1)C(=O)O,C20H18O9,pos_1_1proton,402.09508215599993,RHQXHDXIEARXSC,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 7919,1233,-1,,,,0.0,MS1_match,RHQXHDXIEARXSC-DTLVDHMJSA-N,"InChI=1S/C20H18O9/c21-14-8-6-12(10-15(14)22)7-9-16(23)29-17(18(24)25)20(28,19(26)27)11-13-4-2-1-3-5-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/b9-7+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccccc1)C(=O)O,C20H18O9,pos_1_1proton,402.09508215599993,RHQXHDXIEARXSC,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 7920,1233,-1,,,,0.0,MS1_match,RHQXHDXIEARXSC-DTLVDHMJSA-N,"InChI=1S/C20H18O9/c21-14-8-6-12(10-15(14)22)7-9-16(23)29-17(18(24)25)20(28,19(26)27)11-13-4-2-1-3-5-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/b9-7+/t17-,20-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@](O)(Cc1ccccc1)C(=O)O,C20H18O9,pos_1_1proton,402.09508215599993,RHQXHDXIEARXSC,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 7921,1232,612,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.65448815,ISDB,VYTIKIINPOAJCZ-QUUJIHHWSA-N,"InChI=1S/C39H58O11/c1-19-13-39(32-35(7,50-32)18-45-39)49-23-14-34(6)25-10-9-24-33(4,5)26(48-31-30(47-21(3)41)29(43)22(42)16-44-31)11-12-37(24)17-38(25,37)15-27(46-20(2)40)36(34,8)28(19)23/h19,22-32,42-43H,9-18H2,1-8H3/t19-,22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,32-,34+,35-,36-,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35C[C@@H](OC(C)=O)[C@]3(C)[C@H]6[C@H](C)C[C@]7(OC[C@@]8(C)O[C@@H]78)O[C@H]6C[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)OC[C@@H](O)[C@@H]1O,C39H58O11,,702.397912676,VYTIKIINPOAJCZ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],4,3,8.117952585220337 7922,1232,612,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.65448815,ISDB,VYTIKIINPOAJCZ-UHFFFAOYSA-N,"InChI=1S/C39H58O11/c1-19-13-39(32-35(7,50-32)18-45-39)49-23-14-34(6)25-10-9-24-33(4,5)26(48-31-30(47-21(3)41)29(43)22(42)16-44-31)11-12-37(24)17-38(25,37)15-27(46-20(2)40)36(34,8)28(19)23/h19,22-32,42-43H,9-18H2,1-8H3",CC(=O)OC1C(OC2CCC34CC35CC(OC(C)=O)C3(C)C6C(C)CC7(OCC8(C)OC87)OC6CC3(C)C5CCC4C2(C)C)OCC(O)C1O,C39H58O11,,702.397912676,VYTIKIINPOAJCZ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],4,3,8.117952585220337 7923,1228,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,FYLXQAYYBFZLSK-DYMUGMOBSA-N,"InChI=1S/C21H32O11/c1-5-11-12(6-15-29-9(2)10(3)30-15)13(19(26)27-4)8-28-20(11)32-21-18(25)17(24)16(23)14(7-22)31-21/h5,8-12,14-18,20-25H,1,6-7H2,2-4H3/t9-,10+,11-,12-,14+,15-,16+,17-,18+,20-,21-/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@H]1O[C@@H](C)[C@@H](C)O1,C21H32O11,pos_1_1proton1ammonium,460.194461844,FYLXQAYYBFZLSK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 7924,1227,1111,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.84682614,ISDB,KVDYLKCXTJYREA-UHFFFAOYSA-N,"InChI=1S/C16H22O3/c1-9(2)16-6-5-11(8-19-16)13-12(16)7-10(3)15(18-4)14(13)17/h7,9,11,17H,5-6,8H2,1-4H3",COc1c(C)cc2c(c1O)C1CCC2(C(C)C)OC1,C16H22O3,,262.156894564,KVDYLKCXTJYREA,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Malva sylvestris,121966.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Malva'],['Malva sylvestris'],4,3,8.887304544448853 7925,1226,-1,,,,0.0,MS1_match,BDJSFPZAYZYESM-PDEGOASRSA-N,"InChI=1S/C29H44O5/c1-16-22-17(13-19(31)23(16)32)27(4)10-12-29(6)21-15-26(3,24(33)34)8-7-25(21,2)9-11-28(29,5)20(27)14-18(22)30/h17-21,30-31H,7-15H2,1-6H3,(H,33,34)/t17-,18-,19-,20+,21-,25-,26-,27+,28-,29+/m1/s1",CC1=C2[C@H](O)C[C@H]3[C@@](C)(CC[C@@]4(C)[C@@H]5C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@]34C)[C@@H]2C[C@@H](O)C1=O,C29H44O5,pos_1_1proton1ammonium,472.318874508,BDJSFPZAYZYESM,Terpenoids,Triterpenoids,Friedelane triterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 7926,1226,-1,,,,0.0,MS1_match,QEIFWJNSWAONFY-YXDLWJFISA-N,"InChI=1S/C29H44O5/c1-16-15-20-25(4,22(31)21(16)30)12-14-26(5)18-7-9-28-17(2)29(33,34-23(28)32)10-8-19(28)24(18,3)11-13-27(20,26)6/h16-20,22,31,33H,7-15H2,1-6H3/t16-,17-,18+,19+,20-,22-,24-,25-,26-,27+,28+,29+/m1/s1",C[C@@H]1C[C@@H]2[C@@](C)(CC[C@]3(C)[C@H]4CC[C@@]56C(=O)O[C@@](O)(CC[C@H]5[C@]4(C)CC[C@@]23C)[C@@H]6C)[C@H](O)C1=O,C29H44O5,pos_1_1proton1ammonium,472.318874508,QEIFWJNSWAONFY,Terpenoids,Triterpenoids,Friedelane triterpenoids,Microtropis triflora,1045126.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Microtropis'],['Microtropis triflora'],6,0,6.0 7927,1222,-1,,,,0.0,MS1_match,FEJTUHSIRAJLOJ-UHFFFAOYSA-N,"InChI=1S/C13H14N2O3/c1-8-6-9-11(10(16)7-8)12(13(17)18)15-5-3-2-4-14(9)15/h6-7H,2-5H2,1H3,(H,17,18)",Cc1cc2n3n(c(C(=O)O)c-2c(=O)c1)CCCC3,C13H14N2O3,pos_2MNa,246.100442308,FEJTUHSIRAJLOJ,Alkaloids,,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 7928,1221,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_sodium,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 7929,1221,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_sodium,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 7930,1221,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_sodium,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 7931,1221,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_sodium,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 7932,1221,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_sodium,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 7933,1221,-1,,,,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_sodium,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 7934,1210,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.74396116,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,1,7.475844621658325 7935,1209,69,Terpenoids,Sesquiterpenoids,Furans,0.57329744,ISDB,OUWXZGMEFZQYEK-WQLSENKSSA-N,"InChI=1S/C16H24O2/c1-9-5-6-13(8-12(4)16(17)18)15-11(3)7-10(2)14(9)15/h8-10,13-14H,5-7H2,1-4H3,(H,17,18)/b12-8-",CC1=C2C(/C=C(/C)C(=O)O)CCC(C)C2C(C)C1,C16H24O2,,248.177630008,OUWXZGMEFZQYEK,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,9.293189764022827 7936,1204,-1,,,,0.35327724,ISDB,TUSWWSUBXAJODB-UHFFFAOYSA-N,"InChI=1S/C27H46O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(28)30-22-20-26(2,3)23-19-25(29)31-27(23,4)21-22/h19,22H,5-18,20-21H2,1-4H3",CCCCCCCCCCCCCCCC(=O)OC1CC(C)(C)C2=CC(=O)OC2(C)C1,C27H46O4,,434.339609952,TUSWWSUBXAJODB,Terpenoids,,,Parasenecio deltophyllus,46994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Parasenecio'],['Parasenecio deltophyllus'],4,0,5.413108944892883 7937,1203,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.32771087,ISDB,IJNCLRKOVHEQGU-MNWJJGSNSA-N,"InChI=1S/C25H40O8/c1-11(12(2)26)20(28)33-18-13-7-8-14-23(6,30)17-16-19(32-16)21(3,4)25(17,31)15(27)9-24(14,18)10-22(13,5)29/h11-19,26-27,29-31H,7-10H2,1-6H3/t11-,12+,13+,14-,15+,16-,17-,18+,19-,22+,23+,24-,25-/m0/s1",C[C@H](C(=O)O[C@@H]1[C@H]2CC[C@H]3[C@@](C)(O)[C@@H]4[C@@H]5O[C@@H]5C(C)(C)[C@]4(O)[C@H](O)C[C@@]13C[C@@]2(C)O)[C@@H](C)O,C25H40O8,,468.27231824,IJNCLRKOVHEQGU,Terpenoids,Diterpenoids,Grayanotoxane diterpenoids,Craibiodendron henryi,6049205.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Lyonieae'],['Craibiodendron'],['Craibiodendron henryi'],4,2,6.310843467712402 7938,1201,-1,,,,0.0,MS1_match,LANJQSWIMVURCX-CXSVBUCUSA-N,"InChI=1S/C41H66O14/c1-18-14-20-31(36(4,5)49)55-41(54-20)30(18)37(6)12-13-40-17-39(40)11-10-24(35(2,3)22(39)8-9-23(40)38(37,7)34(41)48)52-32-28(47)29(19(43)16-50-32)53-33-27(46)26(45)25(44)21(15-42)51-33/h18-34,42-49H,8-17H2,1-7H3/t18-,19-,20-,21-,22+,23+,24+,25-,26+,27-,28-,29+,30-,31+,32+,33+,34-,37-,38-,39-,40+,41+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C41H66O14,pos_1_1proton2acetonitrile,782.445256792,LANJQSWIMVURCX,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 7939,1201,-1,,,,0.0,MS1_match,LANJQSWIMVURCX-CXSVBUCUSA-N,"InChI=1S/C41H66O14/c1-18-14-20-31(36(4,5)49)55-41(54-20)30(18)37(6)12-13-40-17-39(40)11-10-24(35(2,3)22(39)8-9-23(40)38(37,7)34(41)48)52-32-28(47)29(19(43)16-50-32)53-33-27(46)26(45)25(44)21(15-42)51-33/h18-34,42-49H,8-17H2,1-7H3/t18-,19-,20-,21-,22+,23+,24+,25-,26+,27-,28-,29+,30-,31+,32+,33+,34-,37-,38-,39-,40+,41+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C41H66O14,pos_1_1proton2acetonitrile,782.445256792,LANJQSWIMVURCX,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 7940,1201,-1,,,,0.0,MS1_match,MWAASJAPNVCCKT-JHNAHLGXSA-N,"InChI=1S/C41H66O14/c1-18-14-20-31(36(4,5)49)55-41(54-20)30(18)37(6)12-13-40-17-39(40)11-10-24(35(2,3)22(39)8-9-23(40)38(37,7)34(41)48)52-33-29(25(44)19(43)16-50-33)53-32-28(47)27(46)26(45)21(15-42)51-32/h18-34,42-49H,8-17H2,1-7H3/t18-,19-,20-,21-,22+,23+,24+,25+,26-,27+,28-,29-,30-,31+,32+,33+,34-,37-,38-,39-,40+,41+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C41H66O14,pos_1_1proton2acetonitrile,782.445256792,MWAASJAPNVCCKT,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 7941,1201,-1,,,,0.0,MS1_match,MWAASJAPNVCCKT-JHNAHLGXSA-N,"InChI=1S/C41H66O14/c1-18-14-20-31(36(4,5)49)55-41(54-20)30(18)37(6)12-13-40-17-39(40)11-10-24(35(2,3)22(39)8-9-23(40)38(37,7)34(41)48)52-33-29(25(44)19(43)16-50-33)53-32-28(47)27(46)26(45)21(15-42)51-32/h18-34,42-49H,8-17H2,1-7H3/t18-,19-,20-,21-,22+,23+,24+,25+,26-,27+,28-,29-,30-,31+,32+,33+,34-,37-,38-,39-,40+,41+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C41H66O14,pos_1_1proton2acetonitrile,782.445256792,MWAASJAPNVCCKT,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 7942,1198,-1,,,,0.2428548,ISDB,,,,,,,DDUFGJDKIPMWMX,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9714192152023315 7943,1197,659,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FOHXFLPXBUAOJM-MGMURXEASA-N,"InChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2/t12-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O13,pos_1_1proton,480.0903907,FOHXFLPXBUAOJM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 7944,1197,659,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FOHXFLPXBUAOJM-MGMURXEASA-N,"InChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2/t12-,15+,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O13,pos_1_1proton,480.0903907,FOHXFLPXBUAOJM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,3,7.5 7945,1196,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 7946,1196,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 7947,1196,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 7948,1196,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 7949,1196,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 7950,1196,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Ranunculus sceleratus,747491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sceleratus'],6,0,6.0 7951,1195,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.86083585,ISDB,BVJSKAUUFXBDOB-UHFFFAOYSA-N,"InChI=1S/C22H45O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(26)29-17-21(25)19-31-32(27,28)30-18-20(24)16-23/h20-21,23-25H,2-19H2,1H3,(H,27,28)",CCCCCCCCCCCCCCCC(=O)OCC(O)COP(=O)(O)OCC(O)CO,C22H45O9P,,484.2801196499999,BVJSKAUUFXBDOB,Fatty acids,Glycerophospholipids,Glycerophosphoglycerols,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,1,7.9433434009552 7952,1193,-1,,,,0.0,MS1_match,ZYURHZPYMFLWSH-UHFFFAOYSA-N,"InChI=1S/C28H58/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3",CCCCCCCCCCCCCCCCCCCCCCCCCCCC,C28H58,pos_1_minus1proton2sodium,394.453851856,ZYURHZPYMFLWSH,Fatty acids,Fatty acyls,Hydrocarbons,Clematis drummondii,384647.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis drummondii'],8,0,8.0 7953,1192,688,Terpenoids,Octadecanoids,Other Octadecanoids,0.5330327,ISDB,RKSYUYCKHRVFNL-UHFFFAOYSA-N,"InChI=1S/C18H30O4/c1-2-17(22-21)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(19)20/h3,5,9,11,13,15,17,21H,2,4,6-8,10,12,14,16H2,1H3,(H,19,20)",CCC(C=CC=CCC=CCCCCCCCC(=O)O)OO,C18H30O4,,310.21440943999994,RKSYUYCKHRVFNL,Fatty acids,Octadecanoids,Other Octadecanoids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,7.632130861282349 7954,1191,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,NGYDXZFNGHZVIS-SKMYYDQESA-N,"InChI=1S/C24H34O10/c1-12(2)7-19(27)34-23-20-17(8-18(32-14(5)25)24(20)11-31-24)16(10-30-23)9-29-22(28)21(13(3)4)33-15(6)26/h10,12-13,17-18,20-21,23H,7-9,11H2,1-6H3/t17-,18+,20-,21-,23+,24-/m1/s1",CC(=O)O[C@H]1C[C@@H]2C(COC(=O)[C@H](OC(C)=O)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C24H34O10,pos_1_1proton1acetonitrile,482.215197288,NGYDXZFNGHZVIS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,0,6.0 7955,1191,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,UPWQTFMGRAGKCN-GMHONNGPSA-N,"InChI=1S/C24H34O10/c1-13(2)7-20(27)33-19-9-18-17(10-30-15(5)25)11-31-23(34-21(28)8-14(3)4)22(18)24(19,29)12-32-16(6)26/h9,11,13-14,19,22-23,29H,7-8,10,12H2,1-6H3/t19-,22+,23-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(C)=O,C24H34O10,pos_1_1proton1acetonitrile,482.21519728799984,UPWQTFMGRAGKCN,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 7956,1191,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,UPWQTFMGRAGKCN-GMHONNGPSA-N,"InChI=1S/C24H34O10/c1-13(2)7-20(27)33-19-9-18-17(10-30-15(5)25)11-31-23(34-21(28)8-14(3)4)22(18)24(19,29)12-32-16(6)26/h9,11,13-14,19,22-23,29H,7-8,10,12H2,1-6H3/t19-,22+,23-,24+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(C)=O,C24H34O10,pos_1_1proton1acetonitrile,482.21519728799984,UPWQTFMGRAGKCN,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana alliariifolia,5746411.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana alliariifolia'],6,0,6.0 7957,1191,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,JCQNBCPVSOEFPG-GMHONNGPSA-N,"InChI=1S/C24H34O10/c1-13(2)7-20(27)30-10-17-11-31-23(34-21(28)8-14(3)4)22-18(17)9-19(33-16(6)26)24(22,29)12-32-15(5)25/h9,11,13-14,19,22-23,29H,7-8,10,12H2,1-6H3/t19-,22+,23-,24+/m0/s1",CC(=O)OC[C@@]1(O)[C@@H](OC(C)=O)C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]21,C24H34O10,pos_1_1proton1acetonitrile,482.215197288,JCQNBCPVSOEFPG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 7958,1190,327,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.8273564,ISDB,NJDITOSUCXZLIG-AUWJEWJLSA-N,"InChI=1S/C17H24O3/c1-13(2)5-4-6-14(12-18)7-8-15-11-16(19)9-10-17(15)20-3/h5,7,9-11,18-19H,4,6,8,12H2,1-3H3/b14-7-",COc1ccc(O)cc1C/C=C(\CO)CCC=C(C)C,C17H24O3,,276.172544628,NJDITOSUCXZLIG,Terpenoids,Meroterpenoids,Merosesquiterpenoids,Heliotropium glutinosum,172317.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Heliotropiaceae'],['Unknown'],['Heliotropium'],['Heliotropium glutinosum'],4,1,7.809425592422485 7959,1189,-1,,,,0.0,MS1_match,OXPXIQPEHBLBIX-VMOHQDNESA-N,"InChI=1S/C43H70O16/c1-19-15-22(33(38(5,6)52)55-20(2)45)59-43(53)32(19)39(7)13-14-42-18-41(42)12-11-26(57-34-30(50)27(47)21(46)17-54-34)37(3,4)24(41)9-10-25(42)40(39,8)36(43)58-35-31(51)29(49)28(48)23(16-44)56-35/h19,21-36,44,46-53H,9-18H2,1-8H3/t19-,21-,22-,23-,24+,25+,26+,27+,28-,29+,30-,31-,32-,33+,34+,35+,36-,39-,40-,41-,42+,43+/m1/s1",CC(=O)O[C@@H]([C@H]1C[C@@H](C)[C@H]2[C@](O)(O1)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C)C(C)(C)O,C43H70O16,pos_2_2proton2acetonitrile,842.46638616,OXPXIQPEHBLBIX,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 7960,1188,-1,,,,0.37644202,ISDB,,,,,,,QTSYLHMNCMQLOC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.505768060684204 7961,1183,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_1_1proton1methanol,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 7962,1183,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_1_1proton1methanol,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 7963,1183,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_1_1proton1methanol,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 7964,1183,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.0,MS1_match,FBUKVWPVBMHYJY-UHFFFAOYSA-N,"InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)",CCCCCCCCC(=O)O,C9H18O2,pos_1_1proton1methanol,158.130679816,FBUKVWPVBMHYJY,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 7965,1178,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IQPNAANSBPBGFQ-UHFFFAOYSA-N,"InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O6,pos_1_1proton,286.04773804,IQPNAANSBPBGFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,2,9.0 7966,1178,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IQPNAANSBPBGFQ-UHFFFAOYSA-N,"InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15H10O6,pos_1_1proton,286.04773804,IQPNAANSBPBGFQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,2,9.0 7967,1172,-1,,,,0.6431708,ISDB,QSOURIMNVDBNHL-HJJINUIOSA-N,"InChI=1S/C15H22O9/c1-4-3-21-14(7-6(4)9(18)13-12(7)23-13)24-15-11(20)10(19)8(17)5(2-16)22-15/h3,5-20H,2H2,1H3/t5-,6-,7+,8-,9+,10+,11-,12-,13+,14+,15+/m1/s1",CC1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H]3O[C@H]3[C@@H](O)[C@H]12,C15H22O9,,346.126382284,QSOURIMNVDBNHL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Deutzia schneideriana,5740083.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Unknown'],['Deutzia'],['Deutzia schneideriana'],4,0,6.572683095932007 7968,1172,-1,,,,0.6431708,ISDB,QSOURIMNVDBNHL-HJJINUIOSA-N,"InChI=1S/C15H22O9/c1-4-3-21-14(7-6(4)9(18)13-12(7)23-13)24-15-11(20)10(19)8(17)5(2-16)22-15/h3,5-20H,2H2,1H3/t5-,6-,7+,8-,9+,10+,11-,12-,13+,14+,15+/m1/s1",CC1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H]3O[C@H]3[C@@H](O)[C@H]12,C15H22O9,,346.126382284,QSOURIMNVDBNHL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Deutzia crenata,5740063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Unknown'],['Deutzia'],['Deutzia crenata'],4,0,6.572683095932007 7969,1172,-1,,,,0.6431708,ISDB,QSOURIMNVDBNHL-HJJINUIOSA-N,"InChI=1S/C15H22O9/c1-4-3-21-14(7-6(4)9(18)13-12(7)23-13)24-15-11(20)10(19)8(17)5(2-16)22-15/h3,5-20H,2H2,1H3/t5-,6-,7+,8-,9+,10+,11-,12-,13+,14+,15+/m1/s1",CC1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H]3O[C@H]3[C@@H](O)[C@H]12,C15H22O9,,346.126382284,QSOURIMNVDBNHL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Deutzia scabra,282338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Unknown'],['Deutzia'],['Deutzia scabra'],4,0,6.572683095932007 7970,1169,-1,,,,0.73942816,ISDB,LLUGDEYQSVTJSI-WBVHZDCISA-N,"InChI=1S/C18H24O2/c1-11-8-12-4-6-15-13(9-14(12)10-16(11)19)5-7-17(20)18(15,2)3/h8-10,15,17,19-20H,4-7H2,1-3H3/t15-,17+/m1/s1",Cc1cc2c(cc1O)C=C1CC[C@H](O)C(C)(C)[C@@H]1CC2,C18H24O2,,272.177630008,LLUGDEYQSVTJSI,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Trigonostemon flavidus,3914668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Trigonostemoneae'],['Trigonostemon'],['Trigonostemon flavidus'],4,0,6.957712650299072 7971,1169,-1,,,,0.73942816,ISDB,LLUGDEYQSVTJSI-WBVHZDCISA-N,"InChI=1S/C18H24O2/c1-11-8-12-4-6-15-13(9-14(12)10-16(11)19)5-7-17(20)18(15,2)3/h8-10,15,17,19-20H,4-7H2,1-3H3/t15-,17+/m1/s1",Cc1cc2c(cc1O)C=C1CC[C@H](O)C(C)(C)[C@@H]1CC2,C18H24O2,,272.177630008,LLUGDEYQSVTJSI,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Ricinodendron heudelotii,976414.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Ricinodendreae'],['Ricinodendron'],['Ricinodendron heudelotii'],4,0,6.957712650299072 7972,1169,-1,,,,0.73942816,ISDB,LLUGDEYQSVTJSI-WBVHZDCISA-N,"InChI=1S/C18H24O2/c1-11-8-12-4-6-15-13(9-14(12)10-16(11)19)5-7-17(20)18(15,2)3/h8-10,15,17,19-20H,4-7H2,1-3H3/t15-,17+/m1/s1",Cc1cc2c(cc1O)C=C1CC[C@H](O)C(C)(C)[C@@H]1CC2,C18H24O2,,272.177630008,LLUGDEYQSVTJSI,Terpenoids,Diterpenoids,Abeoabietane diterpenoids,Trigonostemon chinensis,3914635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Trigonostemoneae'],['Trigonostemon'],['Trigonostemon wui'],4,0,6.957712650299072 7973,1168,541,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1methanol,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 7974,1165,458,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,XWOHZIIPBYAMJX-KHBMLBSESA-N,"InChI=1S/C11H16O5/c1-5-8(12)3-6-7(10(13)15-2)4-16-11(14)9(5)6/h4-6,8-9,11-12,14H,3H2,1-2H3/t5-,6+,8-,9+,11+/m0/s1",COC(=O)C1=CO[C@@H](O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C11H16O5,pos_2MH,228.099773612,XWOHZIIPBYAMJX,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,1,6.5 7975,1165,458,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,HJTVDWWIPXDJBB-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-6(5-12)7-4-8(13)11(2,15)9(7)10(14)16-3/h5,7-9,13,15H,1,4H2,2-3H3",C=C(C=O)C1CC(O)C(C)(O)C1C(=O)OC,C11H16O5,pos_2MH,228.099773612,HJTVDWWIPXDJBB,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,1,6.5 7976,1165,458,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,NGJFTIGDSFYTPY-UHFFFAOYSA-N,"InChI=1S/C11H16O5/c1-11-7(12)3-5-6(4-15-11)10(14-2)16-9(13)8(5)11/h5-8,10,12H,3-4H2,1-2H3",COC1OC(=O)C2C3CC(O)C2(C)OCC13,C11H16O5,pos_2MH,228.099773612,NGJFTIGDSFYTPY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,1,6.5 7977,1164,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.58026403,ISDB,SAHCQBPGXQFTRA-UHFFFAOYSA-N,"InChI=1S/C27H49O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(29)37-18-20(28)19-38-40(35,36)39-27-25(33)23(31)22(30)24(32)26(27)34/h6-7,9-10,20,22-28,30-34H,2-5,8,11-19H2,1H3,(H,35,36)",CCCCCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O,C27H49O12P,,596.2961636379998,SAHCQBPGXQFTRA,Fatty acids,Glycerophospholipids,Glycerophosphoinositols,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,6.321056127548218 7978,1163,-1,,,,0.2196665,ISDB,MLKFESWUFLKYRE-UHFFFAOYSA-N,"InChI=1S/C13H17NO5/c1-19-13(18)10-6-14(4-5-15)12(17)11-8(7-16)2-3-9(10)11/h2,6,9,11,15-16H,3-5,7H2,1H3",COC(=O)C1=CN(CCO)C(=O)C2C(CO)=CCC12,C13H17NO5,,267.110672644,MLKFESWUFLKYRE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Gardenia jasminoides,919367.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Gardenieae'],['Gardenia'],['Gardenia jasminoides'],4,0,4.87866598367691 7979,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Syzygium jambos,731939.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Myrtaceae'],['Syzygieae'],['Syzygium'],['Syzygium jambos'],4,3,8.798351049423218 7980,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Allium fistulosum,856720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium fistulosum'],4,3,8.798351049423218 7981,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Crataegus microphylla,3903788.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Crataegus'],['Crataegus microphylla'],4,3,8.798351049423218 7982,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,3,8.798351049423218 7983,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Cyclopia intermedia,356254.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Podalyrieae'],['Cyclopia'],['Cyclopia intermedia'],4,3,8.798351049423218 7984,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Brickellia vernicosa,5794430.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Brickellia'],['Brickellia vernicosa'],4,3,8.798351049423218 7985,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Salvia officinalis,820645.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia officinalis'],4,3,8.798351049423218 7986,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Cocos nucifera,366250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Arecales'],['Arecaceae'],['Cocoseae'],['Cocos'],['Cocos nucifera'],4,3,8.798351049423218 7987,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Ficus pumila,734180.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Ficus'],['Ficus pumila'],4,3,8.798351049423218 7988,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Paulownia tomentosa,305916.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Paulowniaceae'],['Unknown'],['Paulownia'],['Paulownia tomentosa'],4,3,8.798351049423218 7989,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Cynara cornigera,77866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Cynara'],['Cynara cornigera'],4,3,8.798351049423218 7990,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Artemisia xanthochroa,719387.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia xanthochroa'],4,3,8.798351049423218 7991,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Dalbergia parviflora,3926755.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Dalbergieae'],['Dalbergia'],['Dalbergia parviflora'],4,3,8.798351049423218 7992,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Ocimum basilicum,305911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Ocimum'],['Ocimum basilicum'],4,3,8.798351049423218 7993,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Levisticum officinale,130944.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Unknown'],['Levisticum'],['Levisticum officinale'],4,3,8.798351049423218 7994,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Rhaponticum carthamoides,1012791.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Rhaponticum'],['Rhaponticum carthamoides'],4,3,8.798351049423218 7995,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Punica granatum,646814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Punica'],['Punica granatum'],4,3,8.798351049423218 7996,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Prunus persica,259054.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus persica'],4,3,8.798351049423218 7997,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-CQSZACIVSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m1/s1",COc1ccc([C@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Prunus persica var. nucipersica,200001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus persica'],4,3,8.798351049423218 7998,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Cunila,1097484.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Cunila'],['Unknown'],4,3,8.798351049423218 7999,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.798351049423218 8000,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Lactuca sativa,515700.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Lactuca'],['Lactuca sativa'],4,3,8.798351049423218 8001,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Prunus armeniaca,217632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus armeniaca'],4,3,8.798351049423218 8002,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Apium graveolens var. dulce,86846.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,3,8.798351049423218 8003,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Malus domestica,3902985.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Malus'],['Malus domestica'],4,3,8.798351049423218 8004,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Malus pumila,854961.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Malus'],['Malus pumila'],4,3,8.798351049423218 8005,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,3,8.798351049423218 8006,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Rubus idaeus,156929.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rubus'],['Rubus idaeus'],4,3,8.798351049423218 8007,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Ribes nigrum,248647.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Grossulariaceae'],['Unknown'],['Ribes'],['Ribes nigrum'],4,3,8.798351049423218 8008,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Ribes rubrum,154642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Grossulariaceae'],['Unknown'],['Ribes'],['Ribes rubrum'],4,3,8.798351049423218 8009,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Prunus avium,162547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus avium'],4,3,8.798351049423218 8010,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Brassica oleracea var. viridis,833638.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,3,8.798351049423218 8011,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Brassica oleracea var. italica,209048.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,3,8.798351049423218 8012,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Vaccinium vitis-idaea,242921.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ericaceae'],['Vaccinieae'],['Vaccinium'],['Vaccinium vitis-idaea'],4,3,8.798351049423218 8013,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,3,8.798351049423218 8014,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus aurantifolia,3942427.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus aurantiifolia'],4,3,8.798351049423218 8015,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Apium graveolens,2472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,3,8.798351049423218 8016,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,3,8.798351049423218 8017,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Nepeta tenuifolia,513280.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Schizonepeta'],['Schizonepeta tenuifolia'],4,3,8.798351049423218 8018,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Prunus domestica,731554.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus domestica'],4,3,8.798351049423218 8019,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Brassica oleracea var. sabauda,526294.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,3,8.798351049423218 8020,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Fragaria,208027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Potentilleae'],['Fragaria'],['Unknown'],4,3,8.798351049423218 8021,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-CQSZACIVSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m1/s1",COc1ccc([C@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Chrysothamnus viscidiflorus,1008411.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Chrysothamnus'],['Chrysothamnus viscidiflorus'],4,3,8.798351049423218 8022,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus paradisi,3942423.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus aurantium'],4,3,8.798351049423218 8023,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,3,8.798351049423218 8024,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Melissa officinalis,355945.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Melissa'],['Melissa officinalis'],4,3,8.798351049423218 8025,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus wilsonii,5146114.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus wilsonii'],4,3,8.798351049423218 8026,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Eriodictyon californicum,544709.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Namaceae'],['Unknown'],['Eriodictyon'],['Eriodictyon californicum'],4,3,8.798351049423218 8027,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Allium caesium,497703.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium caesium'],4,3,8.798351049423218 8028,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Lepidium sativum,925289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Lepidieae'],['Lepidium'],['Lepidium sativum'],4,3,8.798351049423218 8029,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Allium schoenoprasum,626975.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium schoenoprasum'],4,3,8.798351049423218 8030,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Coriandrum sativum,2476.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Coriandreae'],['Coriandrum'],['Coriandrum sativum'],4,3,8.798351049423218 8031,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus deliciosa,83847.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus deliciosa'],4,3,8.798351049423218 8032,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Anethum graveolens,378039.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Anethum'],['Anethum graveolens'],4,3,8.798351049423218 8033,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Allium caeruleum,1039969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Amaryllidaceae'],['Allieae'],['Allium'],['Allium caeruleum'],4,3,8.798351049423218 8034,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus,929678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Unknown'],4,3,8.798351049423218 8035,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Rutaceae,43847.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Unknown'],['Unknown'],4,3,8.798351049423218 8036,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus medica,798604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus medica'],4,3,8.798351049423218 8037,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Origanum vulgare,305918.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Origanum'],['Origanum vulgare'],4,3,8.798351049423218 8038,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Petroselinum crispum,2485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Petroselinum'],['Petroselinum crispum'],4,3,8.798351049423218 8039,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Nasturtium officinale,556245.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Cardamineae'],['Nasturtium'],['Nasturtium officinale'],4,3,8.798351049423218 8040,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Rosmarinus officinalis,778824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia rosmarinus'],4,3,8.798351049423218 8041,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus unshiu,1011450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus unshiu'],4,3,8.798351049423218 8042,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Artemisia dracunculus,1070795.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia dracunculus'],4,3,8.798351049423218 8043,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,8.798351049423218 8044,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-AWEZNQCLSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1",COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.07903816799995,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Pisum sativum,359905.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Pisum'],['Pisum sativum'],4,3,8.798351049423218 8045,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus trifoliata,306774.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus trifoliata'],4,3,8.798351049423218 8046,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus grandis,838646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus maxima'],4,3,8.798351049423218 8047,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus maxima,838646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus maxima'],4,3,8.798351049423218 8048,1160,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.82458776,ISDB,AIONOLUJZLIMTK-UHFFFAOYSA-N,"InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3",COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O,C16H14O6,,302.079038168,AIONOLUJZLIMTK,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Citrus reticulata,37136.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus reticulata'],4,3,8.798351049423218 8049,1159,-1,,,,0.32151625,ISDB,CTHDLZOITPXSJS-XPBQOANCSA-N,"InChI=1S/C29H36O2/c1-18-7-11-24(12-8-18)28-26(30-28)16-22(5)20(3)15-21(4)23(6)17-27-29(31-27)25-13-9-19(2)10-14-25/h7-14,20-21,26-29H,5-6,15-17H2,1-4H3/t20-,21+,26-,27-,28-,29-/m1/s1",C=C(C[C@H]1O[C@@H]1c1ccc(C)cc1)[C@H](C)C[C@H](C)C(=C)C[C@H]1O[C@@H]1c1ccc(C)cc1,C29H36O2,,416.27153039199993,CTHDLZOITPXSJS,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Machilus zuihoensis,36198.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Machilus'],['Machilus zuihoensis'],4,0,5.286064982414246 8050,1158,441,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.22400868,ISDB,AKTRFOPOAKDICT-GHHIWPQQSA-N,"InChI=1S/C27H44O16/c1-10(2)3-17(31)43-25-18-12(4-14(30)13(18)5-28)11(7-38-25)8-39-26-24(37)22(35)20(33)16(42-26)9-40-27-23(36)21(34)19(32)15(6-29)41-27/h7,10,12-16,18-30,32-37H,3-6,8-9H2,1-2H3/t12-,13-,14+,15-,16-,18+,19-,20-,21+,22+,23-,24-,25+,26-,27-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@H](CO)[C@@H]12,C27H44O16,,624.262935328,AKTRFOPOAKDICT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.396034717559814 8051,1158,441,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.22400868,ISDB,AKTRFOPOAKDICT-GHHIWPQQSA-N,"InChI=1S/C27H44O16/c1-10(2)3-17(31)43-25-18-12(4-14(30)13(18)5-28)11(7-38-25)8-39-26-24(37)22(35)20(33)16(42-26)9-40-27-23(36)21(34)19(32)15(6-29)41-27/h7,10,12-16,18-30,32-37H,3-6,8-9H2,1-2H3/t12-,13-,14+,15-,16-,18+,19-,20-,21+,22+,23-,24-,25+,26-,27-/m1/s1",CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@H](O)[C@@H](CO)[C@@H]12,C27H44O16,,624.262935328,AKTRFOPOAKDICT,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,8.396034717559814 8052,1156,-1,,,,0.50505817,ISDB,ZLQYEKDHCDLAGO-DDGSWIOPSA-N,"InChI=1S/C30H32O20/c31-7-15-20(38)23(41)25(43)29(48-15)46-10-4-13(34)19-14(5-10)47-27(9-1-2-11(32)12(33)3-9)28(22(19)40)50-30-26(44)24(42)21(39)16(49-30)8-45-18(37)6-17(35)36/h1-5,15-16,20-21,23-26,29-34,38-39,41-44H,6-8H2,(H,35,36)/t15-,16-,20-,21-,23+,24+,25-,26-,29-,30+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C30H32O20,,712.148693424,ZLQYEKDHCDLAGO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,8.020232677459717 8053,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Camellia sinensis,1058509.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Theaceae'],['Unknown'],['Camellia'],['Camellia sinensis'],4,0,5.471621036529541 8054,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-LKUDQCMESA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+",CC1=C(C/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,5.471621036529541 8055,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Daucus carota,372836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Daucus'],['Daucus carota'],4,0,5.471621036529541 8056,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Apium graveolens,2472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Apieae'],['Apium'],['Apium graveolens'],4,0,5.471621036529541 8057,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Cucumis sativus,1006246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Benincaseae'],['Cucumis'],['Cucumis sativus'],4,0,5.471621036529541 8058,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Calendula officinalis,768229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Calenduleae'],['Calendula'],['Calendula officinalis'],4,0,5.471621036529541 8059,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Stachys annua,3882729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Stachys'],['Stachys annua'],4,0,5.471621036529541 8060,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Stachys officinalis,103745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Betonica'],['Betonica officinalis'],4,0,5.471621036529541 8061,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Secale cereale,553015.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Secale'],['Secale cereale'],4,0,5.471621036529541 8062,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Ribes nigrum,248647.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Grossulariaceae'],['Unknown'],['Ribes'],['Ribes nigrum'],4,0,5.471621036529541 8063,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-UHFFFAOYSA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3",CC(=CCC1=C(C)C(=O)c2ccccc2C1=O)CCCC(C)CCCC(C)CCCC(C)C,C31H46O2,,450.349780712,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Glycine,459704.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Unknown'],4,0,5.471621036529541 8064,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Coffea arabica,1001050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Coffea'],['Coffea arabica'],4,0,5.471621036529541 8065,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-LKUDQCMESA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+",CC1=C(C/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Prunus insititia,66998.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus angustifolia'],4,0,5.471621036529541 8066,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-LKUDQCMESA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+",CC1=C(C/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Prunus angustifolia,66998.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus angustifolia'],4,0,5.471621036529541 8067,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Prunus domestica,731554.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus domestica'],4,0,5.471621036529541 8068,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Spinacia oleracea,317784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Anserineae'],['Spinacia'],['Spinacia oleracea'],4,0,5.471621036529541 8069,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,5.471621036529541 8070,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Alhagi persarum,50446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Hedysareae'],['Alhagi'],['Alhagi persarum'],4,0,5.471621036529541 8071,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Alhagi maurorum,809997.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Hedysareae'],['Alhagi'],['Alhagi maurorum'],4,0,5.471621036529541 8072,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-LKUDQCMESA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+",CC1=C(C/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,0,5.471621036529541 8073,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-UHFFFAOYSA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3",CC(=CCC1=C(C)C(=O)c2ccccc2C1=O)CCCC(C)CCCC(C)CCCC(C)C,C31H46O2,,450.349780712,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Lactuca sativa,515700.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Lactuca'],['Lactuca sativa'],4,0,5.471621036529541 8074,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Cannabis sativa,84004.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Cannabis'],['Cannabis sativa'],4,0,5.471621036529541 8075,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-NKFFZRIASA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1",CC1=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Perilla frutescens,295678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Elsholtzieae'],['Perilla'],['Perilla frutescens'],4,0,5.471621036529541 8076,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-UHFFFAOYSA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3",CC(=CCC1=C(C)C(=O)c2ccccc2C1=O)CCCC(C)CCCC(C)CCCC(C)C,C31H46O2,,450.349780712,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Brassica oleracea,833642.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Brassiceae'],['Brassica'],['Brassica oleracea'],4,0,5.471621036529541 8077,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-LKUDQCMESA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+",CC1=C(C/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C(=O)c2ccccc2C1=O,C31H46O2,,450.3497807119999,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Aronia melanocarpa,62443.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Aronia'],['Aronia melanocarpa'],4,0,5.471621036529541 8078,1155,-1,,,,0.36790526,ISDB,MBWXNTAXLNYFJB-UHFFFAOYSA-N,"InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3",CC(=CCC1=C(C)C(=O)c2ccccc2C1=O)CCCC(C)CCCC(C)CCCC(C)C,C31H46O2,,450.349780712,MBWXNTAXLNYFJB,Terpenoids,Meroterpenoids,Prenyl quinone meroterpenoids,Olea europaea,23729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Oleaceae'],['Oleeae'],['Olea'],['Olea europaea'],4,0,5.471621036529541 8079,1153,1346,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MZKARNAOCAPDSD-HSZUAVIASA-N,"InChI=1S/C15H18O3/c1-4-12(2)15(16)18-11-5-6-13-7-9-14(17-3)10-8-13/h4-10H,11H2,1-3H3/b6-5+,12-4-",C/C=C(/C)C(=O)OC/C=C/c1ccc(OC)cc1,C15H18O3,pos_1_1proton,246.125594436,MZKARNAOCAPDSD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,3,7.5 8080,1152,-1,,,,0.0,MS1_match,AIQHURFKXYCRCF-DFKOQAFRSA-N,"InChI=1S/C21H33NO4/c1-3-22-10-18(2)6-5-14(23)21-12-8-11-4-7-19(25,15(12)16(11)24)20(26,17(21)22)9-13(18)21/h11-17,23-26H,3-10H2,1-2H3/t11-,12+,13+,14-,15+,16-,17?,18-,19+,20+,21+/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@]34C1[C@](O)(C[C@H]23)[C@@]1(O)CC[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C21H33NO4,pos_1_1proton,363.240958536,AIQHURFKXYCRCF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium omeiense,699546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium omeiense'],6,0,6.0 8081,1152,-1,,,,0.0,MS1_match,UMENVHXIPMXIRD-AKTDKUJDSA-N,"InChI=1S/C21H33NO4/c1-3-22-9-19(2)5-4-15(24)21-11-6-10-13(23)8-20(26,16(11)17(10)25)12(18(21)22)7-14(19)21/h10-18,23-26H,3-9H2,1-2H3/t10-,11-,12+,13+,14-,15+,16-,17+,18-,19+,20+,21-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6O)[C@@H](C[C@H]23)[C@@H]14,C21H33NO4,pos_1_1proton,363.2409585359999,UMENVHXIPMXIRD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 8082,1152,-1,,,,0.0,MS1_match,XNFQUGPVHYJHHZ-PMCSWTMGSA-N,"InChI=1S/C20H29NO3/c1-9-5-19-4-3-11-18(2)6-10(22)7-20(11)16(19)15(24)12(9)14(23)13(19)17(20)21-8-18/h10-17,21-24H,1,3-8H2,2H3/t10-,11+,12-,13+,14+,15+,16+,17+,18-,19+,20-/m0/s1",C=C1C[C@]23CC[C@@H]4[C@]5(C)CN[C@@H]6[C@H]2[C@H](O)[C@H]1[C@@H](O)[C@H]3[C@@]64C[C@@H](O)C5,C20H29NO3,pos_1_1proton1methanol,331.214743788,XNFQUGPVHYJHHZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,0,6.0 8083,1149,-1,,,,0.37113228,ISDB,UWWCASOGCPOGJP-BQYQJAHWSA-N,"InChI=1S/C13H18O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-8H,9H2,1-4H3/b8-7+",CC(=O)/C=C/C1=C(C)C=CCC1(C)C,C13H18O,,190.135765196,UWWCASOGCPOGJP,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,5.484529137611389 8084,1148,432,Terpenoids,Sesquiterpenoids,Menthane monoterpenoids,0.64216495,ISDB,BCLYZTYBUNEZFV-MCCGJVOXSA-N,"InChI=1S/C14H20O3/c1-12(2)5-8-6-13(8,3)10-9(7-12)14(4,16)17-11(10)15/h8,16H,5-7H2,1-4H3/t8-,13+,14+/m0/s1",CC1(C)CC2=C(C(=O)O[C@@]2(C)O)[C@]2(C)C[C@@H]2C1,C14H20O3,,236.1412445,BCLYZTYBUNEZFV,Terpenoids,Sesquiterpenoids,Africanane sesquiterpenoids,Porella swartziana,250779.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Jungermanniopsida'],['Porellales'],['Porellaceae'],['Unknown'],['Porella'],['Porella swartziana'],0,2,3.568659782409668 8085,1146,-1,,,,0.0,MS1_match,BPDZJMCTHRVRNC-HRAGAMGESA-N,"InChI=1S/C31H54O2/c1-20(2)21(3)12-19-31(9,33)23-13-17-29(7)22(23)10-11-25-28(6)16-15-26(32)27(4,5)24(28)14-18-30(25,29)8/h21-26,32-33H,1,10-19H2,2-9H3/t21-,22+,23-,24-,25+,26-,28-,29+,30+,31+/m0/s1",C=C(C)[C@@H](C)CC[C@@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]12C,C31H54O2,pos_1_1proton1acetonitrile,458.4123809679999,BPDZJMCTHRVRNC,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8086,1146,-1,,,,0.0,MS1_match,BPDZJMCTHRVRNC-HRAGAMGESA-N,"InChI=1S/C31H54O2/c1-20(2)21(3)12-19-31(9,33)23-13-17-29(7)22(23)10-11-25-28(6)16-15-26(32)27(4,5)24(28)14-18-30(25,29)8/h21-26,32-33H,1,10-19H2,2-9H3/t21-,22+,23-,24-,25+,26-,28-,29+,30+,31+/m0/s1",C=C(C)[C@@H](C)CC[C@@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]12C,C31H54O2,pos_1_1proton1acetonitrile,458.4123809679999,BPDZJMCTHRVRNC,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8087,1146,-1,,,,0.0,MS1_match,GHYYPJMOIDQJRP-CFMDIQLFSA-N,"InChI=1S/C31H54O2/c1-20(2)21(3)12-19-31(9,33)23-13-17-29(7)22(23)10-11-25-28(6)16-15-26(32)27(4,5)24(28)14-18-30(25,29)8/h20,22-26,32-33H,3,10-19H2,1-2,4-9H3/t22-,23+,24+,25-,26+,28+,29-,30-,31+/m1/s1",C=C(CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]12C)C(C)C,C31H54O2,pos_1_1proton1acetonitrile,458.4123809679999,GHYYPJMOIDQJRP,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8088,1146,-1,,,,0.0,MS1_match,GHYYPJMOIDQJRP-CFMDIQLFSA-N,"InChI=1S/C31H54O2/c1-20(2)21(3)12-19-31(9,33)23-13-17-29(7)22(23)10-11-25-28(6)16-15-26(32)27(4,5)24(28)14-18-30(25,29)8/h20,22-26,32-33H,3,10-19H2,1-2,4-9H3/t22-,23+,24+,25-,26+,28+,29-,30-,31+/m1/s1",C=C(CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]12C)C(C)C,C31H54O2,pos_1_1proton1acetonitrile,458.4123809679999,GHYYPJMOIDQJRP,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8089,1136,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.58372796,ISDB,AHDPKXPJJKSIRA-QTOFBMCISA-N,"InChI=1S/C34H38O10/c1-15(2)10-11-18-25(35)21-26(36)19-14-20(41-9)22-23(28(19)43-29(21)24-27(18)42-17(4)32(24,5)6)33(7,8)44-34(22,31(39)40)13-12-16(3)30(37)38/h10,12,14,17,35H,11,13H2,1-9H3,(H,37,38)(H,39,40)/b16-12+/t17-,34+/m1/s1",COc1cc2c(=O)c3c(O)c(CC=C(C)C)c4c(c3oc2c2c1[C@@](C/C=C(\C)C(=O)O)(C(=O)O)OC2(C)C)C(C)(C)[C@@H](C)O4,C34H38O10,,606.2464974159999,AHDPKXPJJKSIRA,Polyketides,,,Garcinia elliptica,6099695.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia elliptica'],4,0,6.334911823272705 8090,1136,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.58372796,ISDB,AHDPKXPJJKSIRA-QTOFBMCISA-N,"InChI=1S/C34H38O10/c1-15(2)10-11-18-25(35)21-26(36)19-14-20(41-9)22-23(28(19)43-29(21)24-27(18)42-17(4)32(24,5)6)33(7,8)44-34(22,31(39)40)13-12-16(3)30(37)38/h10,12,14,17,35H,11,13H2,1-9H3,(H,37,38)(H,39,40)/b16-12+/t17-,34+/m1/s1",COc1cc2c(=O)c3c(O)c(CC=C(C)C)c4c(c3oc2c2c1[C@@](C/C=C(\C)C(=O)O)(C(=O)O)OC2(C)C)C(C)(C)[C@@H](C)O4,C34H38O10,,606.2464974159999,AHDPKXPJJKSIRA,Polyketides,,,Garcinia acuminata,311081.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia acuminata'],4,0,6.334911823272705 8091,1136,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.58372796,ISDB,AHDPKXPJJKSIRA-QTOFBMCISA-N,"InChI=1S/C34H38O10/c1-15(2)10-11-18-25(35)21-26(36)19-14-20(41-9)22-23(28(19)43-29(21)24-27(18)42-17(4)32(24,5)6)33(7,8)44-34(22,31(39)40)13-12-16(3)30(37)38/h10,12,14,17,35H,11,13H2,1-9H3,(H,37,38)(H,39,40)/b16-12+/t17-,34+/m1/s1",COc1cc2c(=O)c3c(O)c(CC=C(C)C)c4c(c3oc2c2c1[C@@](C/C=C(\C)C(=O)O)(C(=O)O)OC2(C)C)C(C)(C)[C@@H](C)O4,C34H38O10,,606.2464974159999,AHDPKXPJJKSIRA,Polyketides,,,Garcinia scortechinii,149780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia scortechinii'],4,0,6.334911823272705 8092,1135,109,Terpenoids,Diterpenoids,Estrane steroids,0.0,MS1_match,BNWJOHGLIBDBOB-UHFFFAOYSA-N,"InChI=1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3",C=CCc1cc(OC)c2c(c1)OCO2,C11H12O3,pos_1_1proton2acetonitrile,192.078644244,BNWJOHGLIBDBOB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 8093,1131,886,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,0.24652667,ISDB,,,,,,,XMLQEJGSKUOKGP,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9861066937446594 8094,1130,406,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,HDDLVZWGOPWKFW-UHFFFAOYSA-N,"InChI=1S/C9H14O7/c1-14-6(10)4-9(13,8(12)16-3)5-7(11)15-2/h13H,4-5H2,1-3H3",COC(=O)CC(O)(CC(=O)OC)C(=O)OC,C9H14O7,pos_1_1proton1acetonitrile,234.073952788,HDDLVZWGOPWKFW,Fatty acids,Fatty esters,Wax monoesters,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 8095,1128,-1,,,,0.0,MS1_match,ALMYSFNKELLWOO-XANOUDBCSA-N,"InChI=1S/C15H22O2/c1-8-5-9(16)6-10-12(17)7-11-13(14(11,2)3)15(8,10)4/h6,8,11-13,17H,5,7H2,1-4H3/t8-,11-,12-,13+,15+/m1/s1",C[C@@H]1CC(=O)C=C2[C@H](O)C[C@@H]3[C@@H](C3(C)C)[C@]21C,C15H22O2,pos_1_1proton,234.161979944,ALMYSFNKELLWOO,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 8096,1128,-1,,,,0.0,MS1_match,FUHPCDQQVWLRRY-JQDTZHFSSA-N,"InChI=1S/C15H22O2/c1-9-4-6-12(8-11(3)15(16)17)14-10(2)5-7-13(9)14/h5,8-9,12-14H,4,6-7H2,1-3H3,(H,16,17)/b11-8+/t9-,12+,13-,14+/m1/s1",CC1=CC[C@H]2[C@@H]1[C@H](/C=C(\C)C(=O)O)CC[C@H]2C,C15H22O2,pos_1_1proton,234.161979944,FUHPCDQQVWLRRY,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8097,1128,-1,,,,0.0,MS1_match,CCKOKTXAGCPTTB-IVCYCYMQSA-N,"InChI=1S/C15H22O2/c1-15(2)13-8-6-11(10-16)4-3-5-12(17)7-9-14(13)15/h4,7,9,13-14,16H,3,5-6,8,10H2,1-2H3/b9-7-,11-4+/t13-,14+/m1/s1",CC1(C)[C@@H]2CC/C(CO)=C\CCC(=O)/C=C\[C@@H]21,C15H22O2,pos_1_1proton,234.161979944,CCKOKTXAGCPTTB,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 8098,1128,-1,,,,0.0,MS1_match,CCKOKTXAGCPTTB-IVCYCYMQSA-N,"InChI=1S/C15H22O2/c1-15(2)13-8-6-11(10-16)4-3-5-12(17)7-9-14(13)15/h4,7,9,13-14,16H,3,5-6,8,10H2,1-2H3/b9-7-,11-4+/t13-,14+/m1/s1",CC1(C)[C@@H]2CC/C(CO)=C\CCC(=O)/C=C\[C@@H]21,C15H22O2,pos_1_1proton,234.161979944,CCKOKTXAGCPTTB,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8099,1128,-1,,,,0.0,MS1_match,ZWFIFCRKFITASO-UHFFFAOYSA-N,"InChI=1S/C15H22O2/c1-14(2)11-6-7-15(3)13(17-15)5-4-10(9-16)8-12(11)14/h8-9,11-13H,4-7H2,1-3H3",CC12CCC3C(C=C(C=O)CCC1O2)C3(C)C,C15H22O2,pos_1_1proton,234.161979944,ZWFIFCRKFITASO,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 8100,1128,-1,,,,0.0,MS1_match,ZWFIFCRKFITASO-BTUCRWTDSA-N,"InChI=1S/C15H22O2/c1-14(2)11-6-7-15(3)13(17-15)5-4-10(9-16)8-12(11)14/h8-9,11-13H,4-7H2,1-3H3/b10-8+/t11-,12+,13-,15-/m0/s1",CC1(C)[C@@H]2/C=C(/C=O)CC[C@@H]3O[C@@]3(C)CC[C@@H]21,C15H22O2,pos_1_1proton,234.161979944,ZWFIFCRKFITASO,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,0,6.0 8101,1128,-1,,,,0.0,MS1_match,ZWFIFCRKFITASO-BTUCRWTDSA-N,"InChI=1S/C15H22O2/c1-14(2)11-6-7-15(3)13(17-15)5-4-10(9-16)8-12(11)14/h8-9,11-13H,4-7H2,1-3H3/b10-8+/t11-,12+,13-,15-/m0/s1",CC1(C)[C@@H]2/C=C(/C=O)CC[C@@H]3O[C@@]3(C)CC[C@@H]21,C15H22O2,pos_1_1proton,234.161979944,ZWFIFCRKFITASO,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8102,1128,-1,,,,0.0,MS1_match,HWYGETKWTYJBKT-UHFFFAOYSA-N,"InChI=1S/C15H22O2/c1-10-5-4-6-11(9-16)7-12-13(8-14(10)17)15(12,2)3/h5,7,9,12-14,17H,4,6,8H2,1-3H3",CC1=CCCC(C=O)=CC2C(CC1O)C2(C)C,C15H22O2,pos_1_1proton,234.161979944,HWYGETKWTYJBKT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8103,1128,-1,,,,0.0,MS1_match,CSSWGHXLDCLRSF-DGFSRKRXSA-N,"InChI=1S/C15H22O2/c1-10-6-5-7-11-12(16)8-9-13(14(2,3)17)15(10,11)4/h7-10,13,17H,5-6H2,1-4H3/t10-,13+,15+/m1/s1",C[C@@H]1CCC=C2C(=O)C=C[C@@H](C(C)(C)O)[C@]21C,C15H22O2,pos_1_1proton,234.161979944,CSSWGHXLDCLRSF,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 8104,1128,-1,,,,0.0,MS1_match,KEXOELSKKSEHAC-GQRGDYHCSA-N,"InChI=1S/C15H22O2/c1-9-4-5-13-10(2)6-12(8-14(9)13)7-11(3)15(16)17/h7,10,12-13H,4-6,8H2,1-3H3,(H,16,17)/b11-7+/t10-,12+,13-/m0/s1",CC1=C2C[C@@H](/C=C(\C)C(=O)O)C[C@H](C)[C@@H]2CC1,C15H22O2,pos_1_1proton,234.161979944,KEXOELSKKSEHAC,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 8105,1128,-1,,,,0.0,MS1_match,KEXOELSKKSEHAC-GQRGDYHCSA-N,"InChI=1S/C15H22O2/c1-9-4-5-13-10(2)6-12(8-14(9)13)7-11(3)15(16)17/h7,10,12-13H,4-6,8H2,1-3H3,(H,16,17)/b11-7+/t10-,12+,13-/m0/s1",CC1=C2C[C@@H](/C=C(\C)C(=O)O)C[C@H](C)[C@@H]2CC1,C15H22O2,pos_1_1proton,234.161979944,KEXOELSKKSEHAC,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 8106,1128,-1,,,,0.0,MS1_match,FTRAYGSWEQETHN-BMIGLBTASA-N,"InChI=1S/C15H22O2/c1-9(2)11-5-6-15(4,17)14-12(8-11)10(3)7-13(14)16/h8-10,17H,5-7H2,1-4H3/t10-,15+/m1/s1",CC(C)C1=CC2=C(C(=O)C[C@H]2C)[C@@](C)(O)CC1,C15H22O2,pos_1_1proton,234.161979944,FTRAYGSWEQETHN,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 8107,1128,-1,,,,0.0,MS1_match,FEBNTWHYQKGEIQ-JWRGBUJQSA-N,"InChI=1S/C15H22O2/c1-9-4-6-12(8-11(3)15(16)17)14-10(2)5-7-13(9)14/h8-9,12-13H,4-7H2,1-3H3,(H,16,17)/b11-8-/t9-,12+,13-/m1/s1",CC1=C2[C@H](/C=C(/C)C(=O)O)CC[C@@H](C)[C@H]2CC1,C15H22O2,pos_1_1proton,234.161979944,FEBNTWHYQKGEIQ,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,0,6.0 8108,1128,-1,,,,0.0,MS1_match,FEBNTWHYQKGEIQ-JWRGBUJQSA-N,"InChI=1S/C15H22O2/c1-9-4-6-12(8-11(3)15(16)17)14-10(2)5-7-13(9)14/h8-9,12-13H,4-7H2,1-3H3,(H,16,17)/b11-8-/t9-,12+,13-/m1/s1",CC1=C2[C@H](/C=C(/C)C(=O)O)CC[C@@H](C)[C@H]2CC1,C15H22O2,pos_1_1proton,234.161979944,FEBNTWHYQKGEIQ,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8109,1128,-1,,,,0.0,MS1_match,ALMYSFNKELLWOO-DGFDXLHMSA-N,"InChI=1S/C15H22O2/c1-8-5-9(16)6-10-12(17)7-11-13(14(11,2)3)15(8,10)4/h6,8,11-13,17H,5,7H2,1-4H3/t8-,11-,12-,13+,15+/m0/s1",C[C@H]1CC(=O)C=C2[C@@H](O)C[C@H]3[C@H](C3(C)C)[C@@]21C,C15H22O2,pos_1_1proton,234.161979944,ALMYSFNKELLWOO,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 8110,1128,-1,,,,0.0,MS1_match,WZFLXDPAHIAFNU-STPATLDNSA-N,"InChI=1S/C15H22O2/c1-10(9-16)8-12-5-4-11(2)13-6-7-14(3)15(12,13)17-14/h8-9,11-13H,4-7H2,1-3H3/b10-8+/t11-,12+,13-,14+,15-/m1/s1",C/C(C=O)=C\[C@@H]1CC[C@@H](C)[C@H]2CC[C@]3(C)O[C@]123,C15H22O2,pos_1_1proton,234.161979944,WZFLXDPAHIAFNU,Terpenoids,Sesquiterpenoids,Arteminisin,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8111,1128,-1,,,,0.0,MS1_match,HWYGETKWTYJBKT-UHFFFAOYSA-N,"InChI=1S/C15H22O2/c1-10-5-4-6-11(9-16)7-12-13(8-14(10)17)15(12,2)3/h5,7,9,12-14,17H,4,6,8H2,1-3H3",CC1=CCCC(C=O)=CC2C(CC1O)C2(C)C,C15H22O2,pos_1_1proton,234.161979944,HWYGETKWTYJBKT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 8112,1127,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.2795201,ISDB,CEQHLAVWIQXFHI-MXWKQRLJSA-N,"InChI=1S/C12H20O4/c1-7(2)11(16-14)10-9(12(10,4)5)6-15-8(3)13/h9-11,14H,1,6H2,2-5H3/t9-,10-,11+/m1/s1",C=C(C)[C@H](OO)[C@H]1[C@@H](COC(C)=O)C1(C)C,C12H20O4,,228.13615912,CEQHLAVWIQXFHI,Terpenoids,Monoterpenoids,Irregular monoterpenoids,Achillea nobilis,395150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Achillea'],['Achillea nobilis'],4,2,6.118080377578735 8113,1126,-1,,,,0.30557093,ISDB,NBDMNKOTFDFWNY-KDVKMAFCSA-N,"InChI=1S/C18H28O5/c1-4-5-6-7-8-9-10-11-13-18(21-3)14-12-16(22-23-18)15-17(19)20-2/h6-9,12,14,16H,4-5,10-11,13,15H2,1-3H3/b7-6+,9-8+/t16-,18+/m1/s1",CCC/C=C/C=C/CCC[C@@]1(OC)C=C[C@H](CC(=O)OC)OO1,C18H28O5,,324.193673996,NBDMNKOTFDFWNY,Fatty acids,Fatty Acids and Conjugates,Hydroperoxy fatty acids,Plakortis,425044.0,['Eukaryota'],['Metazoa'],['Porifera'],['Homoscleromorpha'],['Homosclerophorida'],['Plakinidae'],['Unknown'],['Plakortis'],['Unknown'],1,0,2.222283720970154 8114,1125,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,FLIACVVOZYBSBS-UHFFFAOYSA-N,"InChI=1S/C17H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h3-16H2,1-2H3",CCCCCCCCCCCCCCCC(=O)OC,C17H34O2,pos_1_1proton1ammonium,270.255880328,FLIACVVOZYBSBS,Fatty acids,Fatty esters,Wax monoesters,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 8115,1123,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.64312536,ISDB,SEJZCZHZNVUJKW-UHFFFAOYSA-N,"InChI=1S/C20H22O4/c1-5-7-15-9-11-17(19(13-15)21-3)23-24-18-12-10-16(8-6-2)14-20(18)22-4/h5-6,9-14H,1-2,7-8H2,3-4H3",C=CCc1ccc(OOc2ccc(CC=C)cc2OC)c(OC)c1,C20H22O4,,326.151809184,SEJZCZHZNVUJKW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Virola carinata,5700103.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Myristicaceae'],['Unknown'],['Virola'],['Virola carinata'],4,3,8.072501420974731 8116,1117,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,KJZKMUCLXDFCHA-BZXHIDDVSA-N,"InChI=1S/C33H58O18/c1-13-29(17(35)8-23(44-13)49-30-14(2)43-22(36)9-18(30)40-5)48-24-10-19(41-6)31(15(3)45-24)50-25-11-20(42-7)32(16(4)46-25)51-33-28(39)27(38)26(37)21(12-34)47-33/h13-39H,8-12H2,1-7H3/t13-,14-,15-,16-,17+,18+,19-,20-,21-,22-,23+,24+,25+,26-,27+,28-,29-,30+,31-,32+,33+/m1/s1",CO[C@H]1C[C@H](O)O[C@H](C)[C@@H]1O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@@H](OC)[C@H](O[C@H]3C[C@@H](OC)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1,C33H58O18,pos_2_2proton2acetonitrile,742.362315016,KJZKMUCLXDFCHA,Carbohydrates,Saccharides,Polysaccharides,Adonis aleppica,6130911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aleppica'],6,0,6.0 8117,1116,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.74995255,ISDB,IWTONJRAUBPRDR-UXHICEINSA-N,"InChI=1S/C21H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-20(18-22)24-21(19)23/h7-8,19-20,22H,2-6,11-18H2,1H3/t19-,20+/m1/s1",CCCCCCC=CC#CCCCCCC[C@@H]1C[C@@H](CO)OC1=O,C21H34O3,,334.250794948,IWTONJRAUBPRDR,Polyketides,Linear polyketides,Acetogenins,Cananga brandisiana,757934.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Unknown'],['Cananga'],['Cananga brandisiana'],4,1,7.499810218811035 8118,1114,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.6589881,ISDB,OPICXYKVYSNVBV-UHFFFAOYSA-N,"InChI=1S/C27H48O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-22-26(28)24(2)27(23-25)29-3/h22-23,28H,4-21H2,1-3H3",CCCCCCCCCCCCCCCCCCCc1cc(O)c(C)c(OC)c1,C27H48O2,,404.3654307759999,OPICXYKVYSNVBV,Polyketides,Aromatic polyketides,Catechols with side chains,Cichorium spinosum,485943.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Cichorium'],['Cichorium spinosum'],4,0,6.635952472686768 8119,1112,69,Terpenoids,Sesquiterpenoids,Furans,0.539239,ISDB,QFANMAOKAWEBQA-UHFFFAOYSA-N,"InChI=1S/C20H32O2/c1-13(2)10-19(21)22-12-14(3)11-17-8-6-15(4)18-9-7-16(5)20(17)18/h11,13,15,17-18H,6-10,12H2,1-5H3",CC(=CC1CCC(C)C2CCC(C)=C12)COC(=O)CC(C)C,C20H32O2,,304.240230264,QFANMAOKAWEBQA,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,9.15695595741272 8120,1109,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.33439416,ISDB,ILRSCQWREDREME-UHFFFAOYSA-N,"InChI=1S/C12H25NO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H2,13,14)",CCCCCCCCCCCC(N)=O,C12H25NO,,199.19361442,ILRSCQWREDREME,Fatty acids,Fatty amides,Primary amides,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,1,5.837576627731323 8121,1108,-1,,,,0.0,MS1_match,HGQDVTBUGONPNS-XIKSMUEASA-N,"InChI=1S/C20H24O12/c1-9-6-14(7-16(25)27-9)31-20-19(30-13(5)24)18(29-12(4)23)17(28-11(3)22)15(32-20)8-26-10(2)21/h6-7,15,17-20H,8H2,1-5H3/t15-,17-,18+,19-,20-/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2cc(C)oc(=O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C20H24O12,pos_1_sodium,456.126776208,HGQDVTBUGONPNS,,,,Delphinium gracile,209872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gracile'],6,0,6.0 8122,1097,449,Shikimates and Phenylpropanoids,Cyclic polyketides,Cinnamic acids and derivatives,0.0,MS1_match,RUVINXPYWBROJD-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3",CC=Cc1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8123,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,0,7.0 8124,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,0,7.0 8125,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8126,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 8127,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,0,7.0 8128,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,0,7.0 8129,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 8130,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 8131,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8132,1096,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1ammonium,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 8133,1095,1150,Alkaloids,Pseudoalkaloids,Atisane diterpenoids,0.0,MS1_match,MGEDPNBPAMLIHW-WVRIYPJASA-N,"InChI=1S/C21H27NO2/c1-11-7-19-8-20(24)10-22-9-18(2)4-3-5-21(17(18)20)15(19)14(23)12(11)6-13(19)16(21)22/h12-13,15-17,24H,1,3-10H2,2H3/t12-,13-,15-,16-,17+,18+,19+,20+,21+/m1/s1",C=C1C[C@@]23C[C@]4(O)CN5C[C@]6(C)CCC[C@@]7([C@@H]2C(=O)[C@@H]1C[C@@H]3[C@@H]57)[C@@H]64,C21H27NO2,pos_1_1proton2acetonitrile,325.204179104,MGEDPNBPAMLIHW,Terpenoids,Diterpenoids,Atisane diterpenoids,Thalictrum javanicum,124737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum javanicum'],6,3,7.5 8134,1095,1150,Alkaloids,Pseudoalkaloids,Atisane diterpenoids,0.0,MS1_match,MGEDPNBPAMLIHW-UHFFFAOYSA-N,"InChI=1S/C21H27NO2/c1-11-7-19-8-20(24)10-22-9-18(2)4-3-5-21(17(18)20)15(19)14(23)12(11)6-13(19)16(21)22/h12-13,15-17,24H,1,3-10H2,2H3",C=C1CC23CC4(O)CN5CC6(C)CCCC7(C5C2CC1C(=O)C37)C64,C21H27NO2,pos_1_1proton2acetonitrile,325.204179104,MGEDPNBPAMLIHW,Terpenoids,Diterpenoids,Atisane diterpenoids,Thalictrum sessile,124737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum javanicum'],6,3,7.5 8135,1094,142,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,ZAPWQTQNJAINHZ-AEDQHDDNSA-N,"InChI=1S/C58H94O25/c1-24-34(62)39(67)43(71)48(77-24)81-45-37(65)29(61)21-75-50(45)80-33-12-13-54(5)31(55(33,6)23-59)11-14-57(8)32(54)10-9-26-27-19-53(3,4)15-17-58(27,18-16-56(26,57)7)52(73)83-51-46(82-49-44(72)40(68)35(63)25(2)78-49)41(69)38(66)30(79-51)22-76-47-42(70)36(64)28(60)20-74-47/h9,24-25,27-51,59-72H,10-23H2,1-8H3/t24-,25-,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37-,38+,39+,40+,41-,42+,43+,44+,45+,46+,47-,48-,49-,50-,51-,54-,55-,56+,57+,58-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C58H94O25,pos_2_2proton,1190.608418508,ZAPWQTQNJAINHZ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,3,9.5 8136,1092,-1,,,,0.25717783,ISDB,MJOZYOYVRKCTGK-LPJNGZMXSA-N,"InChI=1S/C16H20O10/c17-7-16(24)15(23)13(22)14(26-16)11(20)6-25-12(21)4-2-8-1-3-9(18)10(19)5-8/h1-5,11,13-15,17-20,22-24H,6-7H2/b4-2+/t11-,13-,14-,15+,16-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H](O)[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O,C16H20O10,,372.10564684,MJOZYOYVRKCTGK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nyssa sylvatica,671013.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Nyssaceae'],['Unknown'],['Nyssa'],['Nyssa sylvatica'],4,0,5.028711318969727 8137,1088,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.20657943,ISDB,JVHYYZMBYJJGJM-ZMDGZUOKSA-N,"InChI=1S/C40H54O4/c1-29(17-13-19-31(3)21-22-35(42)38(9)26-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)27-34(44-40)28-39(40,10)43/h11-24,34,43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,38-,39+,40+/m0/s1",CC(/C=C/C=C(C)/C=C/C(=O)[C@]1(C)CC(=O)CC1(C)C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@@H](CC1(C)C)C[C@@]2(C)O,C40H54O4,,598.402210208,JVHYYZMBYJJGJM,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-κ)",Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,5.826317727565765 8138,1087,106,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.43186164,ISDB,XOAJALCOPPOCQU-NZCZKXKFSA-N,"InChI=1S/C21H36O7/c1-11-5-6-15(21(4)8-7-12(9-13(11)21)20(2,3)26)28-19-18(25)17(24)16(23)14(10-22)27-19/h12-19,22-26H,1,5-10H2,2-4H3/t12-,13+,14-,15-,16-,17+,18-,19+,21-/m1/s1",C=C1CC[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]2(C)CC[C@@H](C(C)(C)O)C[C@@H]12,C21H36O7,,400.246103492,XOAJALCOPPOCQU,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Pluchea indica,446140.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pluchea'],['Pluchea indica'],4,3,7.227446556091309 8139,1086,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.74650025,ISDB,JDVDGNAHTZMMBI-UHFFFAOYSA-N,"InChI=1S/C21H36O3/c1-5-7-8-9-10-11-12-13-14-15-16-19-17(3)20(22)18(6-2)21(23-4)24-19/h5-16H2,1-4H3",CCCCCCCCCCCCc1oc(OC)c(CC)c(=O)c1C,C21H36O3,,336.266445012,JDVDGNAHTZMMBI,Polyketides,Cyclic polyketides,4-pyrone derivatives,Podolepis rugata,24091.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Gnaphalieae'],['Podolepis'],['Podolepis rugata'],4,1,7.486001014709473 8140,1085,-1,,,,0.73574775,ISDB,KTPOZFYJWLGJGH-COMQUAJESA-N,"InChI=1S/C15H22O/c1-9-8-10(16)12-13-11(9)15(12,4)7-5-6-14(13,2)3/h8,11-13H,5-7H2,1-4H3/t11-,12+,13-,15+/m1/s1",CC1=CC(=O)[C@H]2[C@H]3[C@@H]1[C@]2(C)CCCC3(C)C,C15H22O,,218.167065324,KTPOZFYJWLGJGH,Terpenoids,Sesquiterpenoids,Longipinane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,8.942991018295288 8141,1084,-1,,,,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_2MHNH3,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 8142,1083,-1,,,,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_1potassium,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 8143,1083,-1,,,,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_1potassium,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 8144,1081,270,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,0.2048093,ISDB,FOOOHAFYCMYYBP-VQWGXQQGSA-N,"InChI=1S/C20H28O11/c1-8(22)10-3-5-11(6-4-10)29-20-18(16(26)14(24)12(7-21)30-20)31-19-17(27)15(25)13(23)9(2)28-19/h3-6,9,12-21,23-27H,7H2,1-2H3/t9-,12-,13-,14-,15+,16+,17-,18-,19+,20-/m0/s1",CC(=O)c1ccc(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@@H]2O)cc1,C20H28O11,,444.163161716,FOOOHAFYCMYYBP,,,,Polygala sibirica,853283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Polygalaceae'],['Unknown'],['Polygala'],['Polygala sibirica'],4,0,4.819237172603607 8145,1081,270,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,0.2048093,ISDB,FOOOHAFYCMYYBP-UHFFFAOYSA-N,"InChI=1S/C20H28O11/c1-8(22)10-3-5-11(6-4-10)29-20-18(16(26)14(24)12(7-21)30-20)31-19-17(27)15(25)13(23)9(2)28-19/h3-6,9,12-21,23-27H,7H2,1-2H3",CC(=O)c1ccc(OC2OC(CO)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)cc1,C20H28O11,,444.163161716,FOOOHAFYCMYYBP,,,,Polygala tenuifolia,378129.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Polygalaceae'],['Unknown'],['Polygala'],['Polygala tenuifolia'],4,0,4.819237172603607 8146,1078,-1,,,,0.0,MS1_match,HKMDHBXRMZEVHY-UHFFFAOYSA-N,"InChI=1S/C16H26O8/c1-7-8-3-4-16(2,9(8)6-22-14(7)21)24-15-13(20)12(19)11(18)10(5-17)23-15/h7-13,15,17-20H,3-6H2,1-2H3",CC1C(=O)OCC2C1CCC2(C)OC1OC(CO)C(O)C(O)C1O,C16H26O8,pos_3_1proton2sodium,346.1627677919999,HKMDHBXRMZEVHY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 8147,1078,-1,,,,0.0,MS1_match,PLSSBWGEYMENGJ-XLIFQNPRSA-N,"InChI=1S/C16H26O8/c1-7-2-3-9-8(5-22-15(21)11(7)9)6-23-16-14(20)13(19)12(18)10(4-17)24-16/h7-14,16-20H,2-6H2,1H3/t7-,8+,9+,10+,11+,12+,13+,14-,16+/m0/s1",C[C@H]1CC[C@@H]2[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)COC(=O)[C@@H]21,C16H26O8,pos_3_1proton2sodium,346.162767792,PLSSBWGEYMENGJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 8148,1076,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_1proton1methanol,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 8149,1076,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_1proton1methanol,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 8150,1076,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_1proton1methanol,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,1,7.5 8151,1075,-1,,,,0.0,MS1_match,NDQUXJOAVAMALR-UHFFFAOYSA-N,"InChI=1S/C31H44O11/c1-9-18(4)26(34)41-24-22(39-25(33)17(2)3)14-29(8,36)31-13-21(28(6,7)42-31)12-23(30(24,31)16-38-19(5)32)40-27(35)20-10-11-37-15-20/h10-11,15,17-18,21-24,36H,9,12-14,16H2,1-8H3",CCC(C)C(=O)OC1C(OC(=O)C(C)C)CC(C)(O)C23CC(CC(OC(=O)c4ccoc4)C12COC(C)=O)C(C)(C)O3,C31H44O11,pos_1_1potassium,592.288362228,NDQUXJOAVAMALR,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,0,7.0 8152,1074,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 8153,1074,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 8154,1074,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 8155,1074,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,3,8.5 8156,1074,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-PXRCHJMLSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.1788117799998,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 8157,1074,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HUVIXLWRQSMCLN-UHFFFAOYSA-N,"InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(OC)OC,C19H30O11,pos_1_1proton1ammonium,434.17881178,HUVIXLWRQSMCLN,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,3,8.5 8158,1073,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.59388983,ISDB,KFTJQBMBWGAXNI-HCLFTBTMSA-N,"InChI=1S/C27H34O2/c1-24(2)21-11-13-27-12-10-20(26(4,29)17-27)15-22(27)25(21,3)16-19(23(24)28)14-18-8-6-5-7-9-18/h5-10,12,14,20-22,29H,11,13,15-17H2,1-4H3/b19-14+/t20-,21+,22-,25+,26-,27+/m0/s1",CC1(C)C(=O)/C(=C/c2ccccc2)C[C@]2(C)[C@@H]1CC[C@@]13C=C[C@@H](C[C@H]12)[C@@](C)(O)C3,C27H34O2,,390.255880328,KFTJQBMBWGAXNI,Terpenoids,Diterpenoids,Atisane diterpenoids,Androstachys johnsonii,510615.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Picrodendraceae'],['Unknown'],['Androstachys'],['Androstachys johnsonii'],4,1,6.875559329986572 8159,1071,-1,,,,0.6943202,ISDB,BPUKUJAZQKFJAN-MLHJIOFPSA-N,"InChI=1S/C18H24O3/c1-5-17(4)10-11-18(12(2)3)20-15(16(17)21-18)13-6-8-14(19)9-7-13/h5-9,12,15-16,19H,1,10-11H2,2-4H3/t15-,16+,17+,18-/m0/s1",C=C[C@]1(C)CC[C@@]2(C(C)C)O[C@@H]1[C@H](c1ccc(O)cc1)O2,C18H24O3,,288.172544628,BPUKUJAZQKFJAN,Terpenoids,Meroterpenoids,Meromonoterpenoids,Cullen corylifolia,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,0,6.777280807495117 8160,1071,-1,,,,0.6943202,ISDB,BPUKUJAZQKFJAN-MLHJIOFPSA-N,"InChI=1S/C18H24O3/c1-5-17(4)10-11-18(12(2)3)20-15(16(17)21-18)13-6-8-14(19)9-7-13/h5-9,12,15-16,19H,1,10-11H2,2-4H3/t15-,16+,17+,18-/m0/s1",C=C[C@]1(C)CC[C@@]2(C(C)C)O[C@@H]1[C@H](c1ccc(O)cc1)O2,C18H24O3,,288.172544628,BPUKUJAZQKFJAN,Terpenoids,Meroterpenoids,Meromonoterpenoids,Cullen corylifolium,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,0,6.777280807495117 8161,1069,-1,,,,0.2381272,ISDB,,,,,,,NGZZXPMEIISLIG,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.952508807182312 8162,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-UHFFFAOYSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3",CCCCCC=CCC=CCCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Ardisia paniculata,1055567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia paniculata'],4,0,6.685897588729858 8163,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-UHFFFAOYSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3",CCCCCC=CCC=CCCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Stylogyne turbacensis,129618.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Stylogyne'],['Stylogyne turbacensis'],4,0,6.685897588729858 8164,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-UHFFFAOYSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3",CCCCCC=CCC=CCCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Mangifera indica,807634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Mangifera'],['Mangifera indica'],4,0,6.685897588729858 8165,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-UHFFFAOYSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3",CCCCCC=CCC=CCCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Embelia ribes,417749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Embelia'],['Embelia ribes'],4,0,6.685897588729858 8166,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-UHFFFAOYSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3",CCCCCC=CCC=CCCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Salvia dorrii,1061904.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia dorrii'],4,0,6.685897588729858 8167,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-HZJYTTRNSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Ardisia complanata,1055567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia paniculata'],4,0,6.685897588729858 8168,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-HZJYTTRNSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Ardisia sanguinolenta,1055567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia paniculata'],4,0,6.685897588729858 8169,1067,-1,,,,0.6714744,ISDB,LQLSZSURMCEKFF-UHFFFAOYSA-N,"InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3",CCCCCC=CCC=CCCCCCCCc1cc(O)cc(O)c1,C23H36O2,,344.271530392,LQLSZSURMCEKFF,Polyketides,Aromatic polyketides,Catechols with side chains,Ardisia colorata,1055567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia paniculata'],4,0,6.685897588729858 8170,1064,-1,,,,0.0,MS1_match,LIXUGUUEUUHFRU-VIFPVBQESA-N,"InChI=1S/C11H14O6/c12-5-9(14)6-17-11(16)3-7-1-2-8(13)4-10(7)15/h1-2,4,9,12-15H,3,5-6H2/t9-/m0/s1",O=C(Cc1ccc(O)cc1O)OC[C@@H](O)CO,C11H14O6,pos_2MHNH3,242.079038168,LIXUGUUEUUHFRU,Shikimates and Phenylpropanoids,,,Nigella damascena,387814.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella damascena'],6,0,6.0 8171,1062,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.0,MS1_match,DCOXHWQGDCRPOB-QKNQBKEWSA-N,"InChI=1S/C21H32O2/c1-13(2)15-11-14-7-8-18-20(3,4)19(22)9-10-21(18,5)16(14)12-17(15)23-6/h11-13,18-19,22H,7-10H2,1-6H3/t18-,19+,21+/m0/s1",COc1cc2c(cc1C(C)C)CC[C@H]1C(C)(C)[C@H](O)CC[C@]21C,C21H32O2,pos_2_1proton1sodium,316.240230264,DCOXHWQGDCRPOB,Terpenoids,Diterpenoids,Podocarpane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 8172,1062,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.0,MS1_match,JSUPHJSYWDZOIC-UHFFFAOYSA-N,"InChI=1S/C21H32O2/c1-13(2)14-7-9-16-15(19(14)23-6)8-10-17-20(3,4)18(22)11-12-21(16,17)5/h7,9,13,17-18,22H,8,10-12H2,1-6H3",COc1c(C(C)C)ccc2c1CCC1C2(C)CCC(O)C1(C)C,C21H32O2,pos_2_1proton1sodium,316.240230264,JSUPHJSYWDZOIC,Terpenoids,Diterpenoids,Abietane diterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 8173,1059,-1,,,,0.0,MS1_match,IUJAMGNYPWYUPM-UHFFFAOYSA-N,"InChI=1S/C31H64/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-31H2,1-2H3",CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC,C31H64,pos_1_minus1proton2potassium,436.500802048,IUJAMGNYPWYUPM,Fatty acids,Fatty acyls,Hydrocarbons,Symphoricarpos albus,717590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Symphoricarpos'],['Symphoricarpos albus'],6,0,6.0 8174,1059,-1,,,,0.0,MS1_match,IUJAMGNYPWYUPM-UHFFFAOYSA-N,"InChI=1S/C31H64/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-31H2,1-2H3",CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC,C31H64,pos_1_minus1proton2potassium,436.500802048,IUJAMGNYPWYUPM,Fatty acids,Fatty acyls,Hydrocarbons,Scabiosa comosa,984352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Scabiosa'],['Scabiosa comosa'],6,0,6.0 8175,1059,-1,,,,0.0,MS1_match,IUJAMGNYPWYUPM-UHFFFAOYSA-N,"InChI=1S/C31H64/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-31H2,1-2H3",CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC,C31H64,pos_1_minus1proton2potassium,436.500802048,IUJAMGNYPWYUPM,Fatty acids,Fatty acyls,Hydrocarbons,Morina kokanica,6061456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina kokanica'],6,0,6.0 8176,1058,-1,,,,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8177,1058,-1,,,,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 8178,1058,-1,,,,0.0,MS1_match,ZHFDCOHUCIESBS-UHFFFAOYSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)C=C(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.178417856,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8179,1058,-1,,,,0.0,MS1_match,ZHFDCOHUCIESBS-KVJIRVJXSA-N,"InChI=1S/C22H28O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h7-8,10,12,17,20-21H,6,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)C=C(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H28O8,pos_2_2proton2acetonitrile,420.1784178559999,ZHFDCOHUCIESBS,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 8180,1057,-1,,,,0.0,MS1_match,IPCSVZSSVZVIGE-UHFFFAOYSA-N,"InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)",CCCCCCCCCCCCCCCC(=O)O,C16H32O2,pos_2MCH3CNNa,256.240230264,IPCSVZSSVZVIGE,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,0,8.0 8181,1053,909,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,pos_1_1proton1acetonitrile,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 8182,1051,-1,,,,0.3599206,ISDB,TWBGKCDUZOAOPO-RUZDIDTESA-N,"InChI=1S/C26H46O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(28-3)24-22-23(2)29-26(24)27/h22,25H,2,4-21H2,1,3H3/t25-/m1/s1",C=C1C=C([C@@H](CCCCCCCCCCCCCCCCCCC)OC)C(=O)O1,C26H46O3,,406.344695332,TWBGKCDUZOAOPO,Polyketides,,,Cinnamomum tenuifolium,5699220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Cinnamomum'],['Cinnamomum tenuifolium'],4,0,5.439682364463806 8183,1049,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.0,MS1_match,AXCXHFKZHDEKTP-UHFFFAOYSA-N,"InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3",COc1ccc(C=CC=O)cc1,C10H10O2,pos_1_1proton,162.06807956,AXCXHFKZHDEKTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina chinensis,68249.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina chinensis'],6,1,6.5 8184,1047,-1,,,,0.44595972,ISDB,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,7.783838868141174 8185,1046,708,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,0.90654796,ISDB,LUTYTNLPIUCKBJ-UHFFFAOYSA-N,"InChI=1S/C15H8O7/c16-5-1-9(19)13-11(2-5)22-15(20)12-6-3-7(17)8(18)4-10(6)21-14(12)13/h1-4,16-19H",O=c1oc2cc(O)cc(O)c2c2oc3cc(O)c(O)cc3c12,C15H8O7,,300.027002596,LUTYTNLPIUCKBJ,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,Eclipta prostrata,189995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Eclipta'],['Eclipta prostrata'],4,3,9.126191854476929 8186,1046,708,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,0.90654796,ISDB,LUTYTNLPIUCKBJ-UHFFFAOYSA-N,"InChI=1S/C15H8O7/c16-5-1-9(19)13-11(2-5)22-15(20)12-6-3-7(17)8(18)4-10(6)21-14(12)13/h1-4,16-19H",O=c1oc2cc(O)cc(O)c2c2oc3cc(O)c(O)cc3c12,C15H8O7,,300.027002596,LUTYTNLPIUCKBJ,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,Eclipta alba,6059538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Eclipta'],['Eclipta alba'],4,3,9.126191854476929 8187,1046,708,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,0.90654796,ISDB,LUTYTNLPIUCKBJ-UHFFFAOYSA-N,"InChI=1S/C15H8O7/c16-5-1-9(19)13-11(2-5)22-15(20)12-6-3-7(17)8(18)4-10(6)21-14(12)13/h1-4,16-19H",O=c1oc2cc(O)cc(O)c2c2oc3cc(O)c(O)cc3c12,C15H8O7,,300.027002596,LUTYTNLPIUCKBJ,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,Sphagneticola calendulacea,599499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Heliantheae'],['Sphagneticola'],['Sphagneticola calendulacea'],4,3,9.126191854476929 8188,1046,708,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,0.90654796,ISDB,LUTYTNLPIUCKBJ-UHFFFAOYSA-N,"InChI=1S/C15H8O7/c16-5-1-9(19)13-11(2-5)22-15(20)12-6-3-7(17)8(18)4-10(6)21-14(12)13/h1-4,16-19H",O=c1oc2cc(O)cc(O)c2c2oc3cc(O)c(O)cc3c12,C15H8O7,,300.027002596,LUTYTNLPIUCKBJ,Shikimates and Phenylpropanoids,Isoflavonoids,Coumestan,Hypericum erectum,304180.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum erectum'],4,3,9.126191854476929 8189,1045,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.41453975,ISDB,,,,,,,TWCSVHBIZBYAON,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6581590175628662 8190,1044,-1,,,,0.60292405,ISDB,,,,,,,ZAFZFHLQBNISDI,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.411696195602417 8191,1042,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.5985135,ISDB,MLQSJCKTTGXTJK-UHFFFAOYSA-N,"InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19(22)23)15-18(21)16-20/h17-18,20-21H,2-16H2,1H3,(H,22,23)",CCCCCCCCCCCCCCC(CC(O)CO)C(=O)O,C19H38O4,,330.277009696,MLQSJCKTTGXTJK,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,2,9.394053936004639 8192,1034,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.47760996,ISDB,,,,,,,GMURXYJSTRMISD,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.9104398488998413 8193,1028,124,Alkaloids,Ornithine alkaloids,Tropane alkaloids,0.0,MS1_match,PUJPMGBYYYNBII-OGVVJMRYSA-N,"InChI=1S/C24H39NO4/c1-6-25-12-22(2)8-7-18(28-4)24-14-9-13-16(27-3)11-23(29-5,19(14)20(13)26)15(21(24)25)10-17(22)24/h13-21,26H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C24H39NO4,pos_2_2proton1ammonium,405.2879087279999,PUJPMGBYYYNBII,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,1,6.5 8194,1025,-1,,,,0.0,MS1_match,MLQSJCKTTGXTJK-UHFFFAOYSA-N,"InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19(22)23)15-18(21)16-20/h17-18,20-21H,2-16H2,1H3,(H,22,23)",CCCCCCCCCCCCCCC(CC(O)CO)C(=O)O,C19H38O4,pos_1_1proton1acetonitrile,330.277009696,MLQSJCKTTGXTJK,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 8195,1025,-1,,,,0.0,MS1_match,QHZLMUACJMDIAE-UHFFFAOYSA-N,"InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3",CCCCCCCCCCCCCCCC(=O)OCC(O)CO,C19H38O4,pos_1_1proton1acetonitrile,330.277009696,QHZLMUACJMDIAE,Fatty acids,Glycerolipids,Monoacylglycerols,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 8196,1025,-1,,,,0.0,MS1_match,QHZLMUACJMDIAE-UHFFFAOYSA-N,"InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3",CCCCCCCCCCCCCCCC(=O)OCC(O)CO,C19H38O4,pos_1_1proton1acetonitrile,330.277009696,QHZLMUACJMDIAE,Fatty acids,Glycerolipids,Monoacylglycerols,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 8197,1022,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.32495207,ISDB,IESVDEZGAHUQJU-PYFUMDFMSA-N,"InChI=1S/C46H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2/h8,10,14,16,20-21,23-24,27,29,33,35,44H,6-7,9,11-13,15,17-19,22,25-26,28,30-32,34,36-43H2,1-5H3/b10-8+,16-14+,21-20+,24-23+,29-27+,35-33+/t44-/m1/s1",CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C46H80NO8P,,805.56215515,IESVDEZGAHUQJU,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,3.7998082637786865 8198,1022,67,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.32495207,ISDB,IESVDEZGAHUQJU-PYFUMDFMSA-N,"InChI=1S/C46H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2/h8,10,14,16,20-21,23-24,27,29,33,35,44H,6-7,9,11-13,15,17-19,22,25-26,28,30-32,34,36-43H2,1-5H3/b10-8+,16-14+,21-20+,24-23+,29-27+,35-33+/t44-/m1/s1",CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C,C46H80NO8P,,805.56215515,IESVDEZGAHUQJU,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,3.7998082637786865 8199,1019,394,Fatty acids,Fatty amides,Wax monoesters,0.21407393,ISDB,,,,,,,ZDQKGEKGLGASGB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8562957048416138 8200,1018,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.60357153,ISDB,YURWZDJEVHQYGV-DOJUMQAQSA-N,"InChI=1S/C19H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(21)22-2/h10-11,18,20H,3-9,12-17H2,1-2H3/b11-10+/t18-/m1/s1",CCCCCCCC/C=C/CCCCCC[C@@H](O)C(=O)OC,C19H36O3,,312.266445012,YURWZDJEVHQYGV,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Salvia nilotica,861976.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Salvia'],['Salvia nilotica'],4,3,7.914286136627197 8201,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Chamomilla recutita,145582.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Matricaria'],['Matricaria chamomilla'],4,3,8.522033452987671 8202,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Croton hutchinsonianus,870958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton hutchinsonianus'],4,3,8.522033452987671 8203,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-UHFFFAOYSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3",CC(=O)CCC=C(C)CCC=C(C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Cecropia pachystachya,3907842.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Urticaceae'],['Unknown'],['Cecropia'],['Cecropia pachystachya'],4,3,8.522033452987671 8204,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-UHFFFAOYSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3",CC(=O)CCC=C(C)CCC=C(C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Agrimonia pilosa,383278.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Sanguisorbeae'],['Agrimonia'],['Agrimonia pilosa'],4,3,8.522033452987671 8205,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Daucus carota,372836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Scandiceae'],['Daucus'],['Daucus carota'],4,3,8.522033452987671 8206,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Bixa orellana,287352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Bixaceae'],['Unknown'],['Bixa'],['Bixa orellana'],4,3,8.522033452987671 8207,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-UHFFFAOYSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3",CC(=O)CCC=C(C)CCC=C(C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Scutellaria barbata,1093028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Scutellaria'],['Scutellaria barbata'],4,3,8.522033452987671 8208,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-UHFFFAOYSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3",CC(=O)CCC=C(C)CCC=C(C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Rhus coriaria,598784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Rhus'],['Rhus coriaria'],4,3,8.522033452987671 8209,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Centaurea armena,674587.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Centaurea'],['Centaurea armena'],4,3,8.522033452987671 8210,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Centaurea sessilis,7613406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Centaurea'],['Centaurea sessilis'],4,3,8.522033452987671 8211,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Centaurea oltensis,3894076.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Centaurea'],['Centaurea oltensis'],4,3,8.522033452987671 8212,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Artemisia annua,637444.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia annua'],4,3,8.522033452987671 8213,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Tordylium apulum,630025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Tordylieae'],['Tordylium'],['Tordylium apulum'],4,3,8.522033452987671 8214,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Daphne odora,5747002.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Daphne'],['Daphne odora'],4,3,8.522033452987671 8215,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Citrullus lanatus,1006251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cucurbitales'],['Cucurbitaceae'],['Benincaseae'],['Citrullus'],['Citrullus lanatus'],4,3,8.522033452987671 8216,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Matricaria chamomilla,145582.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Matricaria'],['Matricaria chamomilla'],4,3,8.522033452987671 8217,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Tilia platyphyllos,1067735.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Tilia'],['Tilia platyphyllos'],4,3,8.522033452987671 8218,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Tilia tomentosa,495951.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Tilia'],['Tilia tomentosa'],4,3,8.522033452987671 8219,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Tilia mandshurica,790022.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Unknown'],['Tilia'],['Tilia mandshurica'],4,3,8.522033452987671 8220,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Mangifera indica,807634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Mangifera'],['Mangifera indica'],4,3,8.522033452987671 8221,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Cannabis sativa,84004.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Cannabis'],['Cannabis sativa'],4,3,8.522033452987671 8222,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.522033452987671 8223,1017,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.75550836,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],4,3,8.522033452987671 8224,1016,955,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.22965382,ISDB,IYMQKDCNKPOJCA-UHFFFAOYSA-N,"InChI=1S/C16H21NO6/c1-8-15(21-2)13(19)14(20)16(22-8)23-10-5-3-4-9-6-7-11(18)17-12(9)10/h3-5,8,13-16,19-20H,6-7H2,1-2H3,(H,17,18)",COC1C(C)OC(Oc2cccc3c2NC(=O)CC3)C(O)C1O,C16H21NO6,,323.136887392,IYMQKDCNKPOJCA,,,,Actinomadura,305623.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptosporangiales'],['Thermomonosporaceae'],['Unknown'],['Actinomadura'],['Unknown'],0,0,0.9186152815818787 8225,1012,-1,,,,0.0,MS1_match,KUCPEGRFGJINTH-RTBURBONSA-N,"InChI=1S/C19H28O7/c1-5-23-18-14(10-25-16(22)7-11(3)4)12-8-15(21)13(9-20)17(12)19(26-18)24-6-2/h11,18-20H,5-10H2,1-4H3/t18-,19-/m1/s1",CCO[C@@H]1O[C@@H](OCC)C2=C(CO)C(=O)CC2=C1COC(=O)CC(C)C,C19H28O7,pos_1_1proton,368.183503236,KUCPEGRFGJINTH,Terpenoids,,,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,0,6.0 8226,1008,-1,,,,0.24056879,ISDB,LDJGFVIFCPBTNK-ZLSCPPGSSA-N,"InChI=1S/C25H31NO3/c1-20(2)8-7-16-25(3,28)17-19-29-23-13-11-21(12-14-23)15-18-26-24(27)22-9-5-4-6-10-22/h4-14,16,28H,15,17-19H2,1-3H3,(H,26,27)/b16-7+/t25-/m1/s1",CC(C)=C/C=C/[C@@](C)(O)CCOc1ccc(CCNC(=O)c2ccccc2)cc1,C25H31NO3,,393.230393852,LDJGFVIFCPBTNK,,,,Casimiroa pubescens,6125401.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Casimiroa'],['Casimiroa pubescens'],4,0,4.962275147438049 8227,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MHNH3,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8228,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MHNH3,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8229,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MHNH3,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8230,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MHNH3,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8231,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MHNH3,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8232,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MHNH3,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8233,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_2MHNH3,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8234,1003,1518,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_2MHNH3,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8235,1002,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,JNPXCTROEJQHKD-KAZAEUKGSA-N,"InChI=1S/C21H30O13/c1-2-9-10-3-4-29-17(27)11(10)5-30-18(9)34-19-15(25)14(24)13(23)12(33-19)6-31-20-16(26)21(28,7-22)8-32-20/h2,5,9-10,12-16,18-20,22-26,28H,1,3-4,6-8H2/t9-,10-,12+,13+,14-,15+,16-,18-,19-,20+,21+/m0/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C21H30O13,pos_1_1proton1ammonium,490.16864102,JNPXCTROEJQHKD,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,2,8.0 8236,999,527,Terpenoids,Diterpenoids,Menthane monoterpenoids,0.0,MS1_match,RECUKUPTGUEGMW-UHFFFAOYSA-N,"InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3",Cc1ccc(C(C)C)cc1O,C10H14O,pos_2MH,150.104465068,RECUKUPTGUEGMW,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 8237,996,-1,,,,0.0,MS1_match,MXTRNUZJGMQISX-FCFRRXDASA-N,"InChI=1S/C25H37NO8/c1-5-26-10-13-6-7-16(30-3)24-17(13)20(34-12(2)27)25(21(24)26)23(32-11-33-25)9-15(28)14-8-22(24,29)19(23)18(14)31-4/h13-21,28-29H,5-11H2,1-4H3/t13-,14+,15-,16-,17-,18-,19-,20-,21-,22-,23+,24+,25+/m0/s1",CCN1C[C@@H]2CC[C@H](OC)[C@]34[C@@H]2[C@H](OC(C)=O)[C@@]2(OCO[C@@]25C[C@H](O)[C@H]2C[C@]3(O)[C@@H]5[C@H]2OC)[C@@H]14,C25H37NO8,pos_1_1proton1ethylamine,479.251917144,MXTRNUZJGMQISX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium anthriscifolium,511671.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium anthriscifolium'],6,0,6.0 8238,994,-1,,,,0.0,MS1_match,AFNCJAGURSSCGO-UHFFFAOYSA-N,"InChI=1S/C27H37NO7/c1-6-11(2)22(32)35-15-9-26-18-14-8-25-7-12(3)16(17(30)19(25)26)20(31)27(25,33)23(26)28(14)10-24(18,5)21(15)34-13(4)29/h11,14-21,23,30-31,33H,3,6-10H2,1-2,4-5H3",C=C1CC23CC4C5C6(C)CN4C4C5(CC(OC(=O)C(C)CC)C6OC(C)=O)C2C(O)C1C(O)C43O,C27H37NO7,pos_2_2proton3acetonitrile,487.257002524,AFNCJAGURSSCGO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glandulosum,260818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida glandulosa'],6,0,6.0 8239,993,-1,,,,0.29439577,ISDB,XMLSXPIVAXONDL-PLNGDYQASA-N,"InChI=1S/C11H16O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5H,3,6-8H2,1-2H3/b5-4-",CC/C=C\CC1=C(C)CCC1=O,C11H16O,,164.120115132,XMLSXPIVAXONDL,Fatty acids,Octadecanoids,Jasmonic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,8.17758309841156 8240,990,203,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,0.0,MS1_match,UFWIBTONFRDIAS-UHFFFAOYSA-N,InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H,c1ccc2ccccc2c1,C10H8,pos_2MH,128.062600256,UFWIBTONFRDIAS,Shikimates and Phenylpropanoids,Phenanthrenoids,Phenanthrenes,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8241,988,213,Polyketides,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,NPCIWINHUDIWAV-LJQANCHMSA-N,"InChI=1S/C22H35IO2/c1-19(18-22(24)25)12-10-8-6-4-2-3-5-7-9-11-13-20-14-16-21(23)17-15-20/h14-17,19H,2-13,18H2,1H3,(H,24,25)/t19-/m1/s1",C[C@H](CCCCCCCCCCCCc1ccc(I)cc1)CC(=O)O,C22H35IO2,pos_1_1proton1isopropanol,458.16817836,NPCIWINHUDIWAV,Polyketides,,,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,1,6.5 8242,987,-1,,,,0.44292077,ISDB,HKCVQKQNBZLFNI-MAUKXSAKSA-N,"InChI=1S/C18H33NO3/c1-5-6-7-8-9-10-11-12-13-14-18(22-17(4)21)15(2)19-16(3)20/h5,15,18H,1,6-14H2,2-4H3,(H,19,20)/t15-,18+/m0/s1",C=CCCCCCCCCC[C@@H](OC(C)=O)[C@H](C)NC(C)=O,C18H33NO3,,311.246043916,HKCVQKQNBZLFNI,,,,Haliclona,588763.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Haplosclerida'],['Chalinidae'],['Unknown'],['Haliclona'],['Unknown'],1,0,2.771683096885681 8243,974,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_2MCH3CNNa,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 8244,974,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,UASMTJSLCCDICT-UHFFFAOYSA-N,"InChI=1S/C13H18O2/c1-9-3-2-4-11(13(14)15)8-12-7-10(12)6-5-9/h3,8,10,12H,2,4-7H2,1H3,(H,14,15)",CC1=CCCC(C(=O)O)=CC2CC2CC1,C13H18O2,pos_2MCH3CNNa,206.130679816,UASMTJSLCCDICT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8245,973,-1,,,,0.0,MS1_match,MRIAQLRQZPPODS-UHFFFAOYSA-N,"InChI=1S/C21H22O8/c1-23-13-8-7-11(9-15(13)24-2)14-10-12(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-14/h7-10H,1-6H3",COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1OC,C21H22O8,pos_1_1proton,402.1314676639999,MRIAQLRQZPPODS,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,0,6.0 8246,971,-1,,,,0.32907468,ISDB,KRTAGCAAGRLSRQ-UHFFFAOYSA-N,"InChI=1S/C18H28O5/c1-11-10-12-14-16(2,15(21)23-12)7-5-8-17(14,3)18(11,22)9-4-6-13(19)20/h11-12,14,22H,4-10H2,1-3H3,(H,19,20)",CC1CC2OC(=O)C3(C)CCCC(C)(C23)C1(O)CCCC(=O)O,C18H28O5,,324.193673996,KRTAGCAAGRLSRQ,Terpenoids,Diterpenoids,Labdane diterpenoids,Marrubium globosum,6081188.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Marrubieae'],['Marrubium'],['Marrubium globosum'],4,0,5.316298723220825 8247,966,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1potassium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 8248,966,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1potassium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 8249,965,-1,,,,0.0,MS1_match,XEOKATHZLYGOQV-GVODYPPYSA-N,"InChI=1S/C36H58O11/c1-16-12-17-27(31(4,5)43)47-36(46-17)26(16)32(6)10-11-34-15-35(34)19(8-9-20(34)33(32,7)29(36)42)30(2,3)22(13-21(35)38)45-28-25(41)24(40)23(39)18(14-37)44-28/h16-29,37-43H,8-15H2,1-7H3/t16-,17-,18-,19+,20-,21+,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34+,35-,36+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)C[C@H](O)[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C36H58O11,pos_1_sodium,666.397912676,XEOKATHZLYGOQV,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8250,965,-1,,,,0.0,MS1_match,XEOKATHZLYGOQV-GVODYPPYSA-N,"InChI=1S/C36H58O11/c1-16-12-17-27(31(4,5)43)47-36(46-17)26(16)32(6)10-11-34-15-35(34)19(8-9-20(34)33(32,7)29(36)42)30(2,3)22(13-21(35)38)45-28-25(41)24(40)23(39)18(14-37)44-28/h16-29,37-43H,8-15H2,1-7H3/t16-,17-,18-,19+,20-,21+,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34+,35-,36+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)C[C@H](O)[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C36H58O11,pos_1_sodium,666.397912676,XEOKATHZLYGOQV,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8251,964,-1,,,,0.0,MS1_match,FNYPZWBJPFEVFN-YLCGFITOSA-N,"InChI=1S/C23H29NO10/c1-2-14-15(6-5-13-4-3-7-24(10-13)8-9-25)16(21(30)31)12-32-22(14)34-23-20(29)19(28)18(27)17(11-26)33-23/h2-7,10,12,14-15,17-20,22-23,25-29H,1,8-9,11H2/b6-5+/t14-,15+,17-,18-,19+,20-,22+,23+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCO)c1,C23H29NO10,pos_2_2proton1ammonium,479.179146128,FNYPZWBJPFEVFN,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8252,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,2,7.0 8253,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana grossheimii,6061646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana grossheimii'],6,2,7.0 8254,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,2,7.0 8255,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,2,7.0 8256,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,2,7.0 8257,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 8258,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 8259,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,2,7.0 8260,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,2,7.0 8261,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis var. latifolia,430697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 8262,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-GUGJDKNPSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20-,21+,22+/m0/s1",CC(=O)OCC1=CO[C@H](OC(=O)CC(C)C)[C@@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.19406792,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,2,7.0 8263,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,2,7.0 8264,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,2,7.0 8265,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana altaica,6061579.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana altaica'],6,2,7.0 8266,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,2,7.0 8267,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,2,7.0 8268,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,2,7.0 8269,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,2,7.0 8270,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,2,7.0 8271,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,2,7.0 8272,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 8273,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,2,7.0 8274,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,2,7.0 8275,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-UHFFFAOYSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,2,7.0 8276,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-UHFFFAOYSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus,759046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Unknown'],6,2,7.0 8277,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,2,7.0 8278,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,2,7.0 8279,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,2,7.0 8280,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana condamoana,6061611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana condamoana'],6,2,7.0 8281,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana tuberosa,981574.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana tuberosa'],6,2,7.0 8282,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana alpestris,5746412.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana alpestris'],6,2,7.0 8283,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,2,7.0 8284,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,2,7.0 8285,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,2,7.0 8286,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,2,7.0 8287,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,2,7.0 8288,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,2,7.0 8289,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,2,7.0 8290,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,2,7.0 8291,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,2,7.0 8292,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,2,7.0 8293,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,2,7.0 8294,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,2,7.0 8295,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana colchica,6061608.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana colchica'],6,2,7.0 8296,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,2,7.0 8297,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,2,7.0 8298,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 8299,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,2,7.0 8300,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,2,7.0 8301,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana condamoana,6061611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana condamoana'],6,2,7.0 8302,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,2,7.0 8303,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 8304,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,2,7.0 8305,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-UHFFFAOYSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana alliariifolia,5746411.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana alliariifolia'],6,2,7.0 8306,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana tripteris,445625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana tripteris'],6,2,7.0 8307,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana stolonifera,5746447.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana stolonifera'],6,2,7.0 8308,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capitata,746281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capitata'],6,2,7.0 8309,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 8310,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,2,7.0 8311,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-UHFFFAOYSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3",CC(=O)OC1C=C2C(COC(=O)CC(C)C)=COC(OC(=O)CC(C)C)C2C12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,2,7.0 8312,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 8313,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pseudofficinalis,245963.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pseudofficinalis'],6,2,7.0 8314,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus macrosiphon,231861.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus macrosiphon'],6,2,7.0 8315,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus ruber,759056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Centranthus ruber'],6,2,7.0 8316,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,XLACUABANMZLCJ-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)O[C@H]1C=C2C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C22H30O8,pos_2_1proton1sodium,422.1940679199999,XLACUABANMZLCJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,2,7.0 8317,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Fedia cornucopiae,945863.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Fedia'],['Fedia cornucopiae'],6,2,7.0 8318,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella coronata,445620.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella coronata'],6,2,7.0 8319,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,2,7.0 8320,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sambucifolia,746279.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sambucifolia'],6,2,7.0 8321,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella locusta,459098.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella locusta'],6,2,7.0 8322,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,2,7.0 8323,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-UHFFFAOYSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,2,7.0 8324,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,2,7.0 8325,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,2,7.0 8326,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana condamoana,6061611.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana condamoana'],6,2,7.0 8327,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana micropterina,6061682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana micropterina'],6,2,7.0 8328,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana edulis,646604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana edulis'],6,2,7.0 8329,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 8330,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 8331,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 8332,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 8333,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-UHFFFAOYSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Centranthus,759046.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Centranthus'],['Unknown'],6,2,7.0 8334,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,2,7.0 8335,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valerianella dentata,476255.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valerianella'],['Valerianella dentata'],6,2,7.0 8336,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-GUGJDKNPSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20-,21+,22+/m0/s1",CC(=O)OCC1=CO[C@H](OC(=O)CC(C)C)[C@@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.19406792,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,2,7.0 8337,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 8338,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 8339,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 8340,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana,393345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Unknown'],6,2,7.0 8341,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,2,7.0 8342,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana tripteris,445625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana tripteris'],6,2,7.0 8343,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana stolonifera,5746447.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana stolonifera'],6,2,7.0 8344,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capitata,746281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capitata'],6,2,7.0 8345,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana alpestris,5746412.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana alpestris'],6,2,7.0 8346,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana colchica,6061608.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana colchica'],6,2,7.0 8347,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-UHFFFAOYSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3",CC(=O)OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)C)C21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana alliariifolia,5746411.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana alliariifolia'],6,2,7.0 8348,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana altaica,6061579.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana altaica'],6,2,7.0 8349,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana grossheimii,6061646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana grossheimii'],6,2,7.0 8350,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana wolgensis,5746446.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana wolgensis'],6,2,7.0 8351,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,2,7.0 8352,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana glechomifolia,6061640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana glechomifolia'],6,2,7.0 8353,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 8354,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 8355,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,2,7.0 8356,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,2,7.0 8357,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis var. latifolia,430697.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 8358,960,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,BDIAUFOIMFAIPU-KVJIRVJXSA-N,"InChI=1S/C22H30O8/c1-12(2)6-18(24)29-17-8-16-15(9-26-14(5)23)10-27-21(20(16)22(17)11-28-22)30-19(25)7-13(3)4/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3/t17-,20+,21-,22+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]21CO1,C22H30O8,pos_2_1proton1sodium,422.1940679199999,BDIAUFOIMFAIPU,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana tuberosa,981574.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana tuberosa'],6,2,7.0 8359,958,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8360,958,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 8361,958,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,BESWSXOVDJDSKQ-HUJQHWLQSA-N,"InChI=1S/C17H24O3/c1-11-6-5-7-13(19)8-9-14-16(17(14,3)4)15(10-11)20-12(2)18/h6,8-9,14-16H,5,7,10H2,1-4H3/b9-8-,11-6-/t14-,15+,16-/m0/s1",CC(=O)O[C@@H]1C/C(C)=C\CCC(=O)/C=C\[C@H]2[C@@H]1C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,BESWSXOVDJDSKQ,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8362,958,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,3,7.5 8363,958,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,MQNYOYOQPDJLJV-PEXFBTPGSA-N,"InChI=1S/C17H24O3/c1-12(18)20-11-13-5-4-6-14(19)8-10-16-15(9-7-13)17(16,2)3/h5,8,10,15-16H,4,6-7,9,11H2,1-3H3/b10-8-,13-5+/t15-,16+/m1/s1",CC(=O)OC/C1=C/CCC(=O)/C=C\[C@H]2[C@@H](CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,MQNYOYOQPDJLJV,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8364,958,1551,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,0.0,MS1_match,VGOHBZXHAWVRBT-UHFFFAOYSA-N,"InChI=1S/C17H24O3/c1-12(19)20-11-13-5-4-6-14(10-18)9-16-15(8-7-13)17(16,2)3/h5,9-10,15-16H,4,6-8,11H2,1-3H3",CC(=O)OCC1=CCCC(C=O)=CC2C(CC1)C2(C)C,C17H24O3,pos_1_1proton1methanol,276.172544628,VGOHBZXHAWVRBT,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,3,7.5 8365,956,123,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.62296194,ISDB,DLDZDBDYUZLISX-QGZVFWFLSA-N,"InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m1/s1",COc1ccc(C[C@@H]2c3cc(O)c(OC)cc3CCN2C)cc1,C19H23NO3,,313.167793596,DLDZDBDYUZLISX,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Aconitum leucostomum,723178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum leucostomum'],6,3,9.99184775352478 8366,955,1178,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_sodium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,3,9.5 8367,955,1178,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_sodium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,3,9.5 8368,953,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8369,953,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,0,6.0 8370,953,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulchella,5746422.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulchella'],6,0,6.0 8371,953,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 8372,953,-1,,,,0.0,MS1_match,NQYKVDKWBKOHRD-UHFFFAOYSA-N,"InChI=1S/C23H34O8/c1-6-14(4)8-20(26)31-22-21-17(9-18(30-15(5)24)23(21)12-29-23)16(11-28-22)10-27-19(25)7-13(2)3/h11,13-14,17-18,21-22H,6-10,12H2,1-5H3",CCC(C)CC(=O)OC1OC=C(COC(=O)CC(C)C)C2CC(OC(C)=O)C3(CO3)C12,C23H34O8,pos_2_2proton2acetonitrile,438.225368048,NQYKVDKWBKOHRD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana capensis,135852.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana capensis'],6,0,6.0 8373,951,-1,,,,0.3547495,ISDB,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,8.418998003005981 8374,951,-1,,,,0.3547495,ISDB,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,8.418998003005981 8375,951,-1,,,,0.3547495,ISDB,JNNGEAWILNVFFD-CDJYTOATSA-N,"InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1",C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@@H]1O,C16H24O10,,376.1369469679999,JNNGEAWILNVFFD,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,8.418998003005981 8376,950,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.2998653,ISDB,SBENKNZHVXGNTP-UHFFFAOYSA-N,"InChI=1S/C11H14O3/c1-13-7-3-4-9-5-6-10(12)11(8-9)14-2/h3-6,8,12H,7H2,1-2H3",COCC=Cc1ccc(O)c(OC)c1,C11H14O3,,194.094294308,SBENKNZHVXGNTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Ligusticum chuanxiong,200246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Unknown'],['Ligusticum'],['Ligusticum sinense'],4,3,6.699461221694946 8377,950,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.2998653,ISDB,SBENKNZHVXGNTP-UHFFFAOYSA-N,"InChI=1S/C11H14O3/c1-13-7-3-4-9-5-6-10(12)11(8-9)14-2/h3-6,8,12H,7H2,1-2H3",COCC=Cc1ccc(O)c(OC)c1,C11H14O3,,194.094294308,SBENKNZHVXGNTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Ligusticum striatum,3889924.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Unknown'],['Ligusticum'],['Ligusticum striatum'],4,3,6.699461221694946 8378,950,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.2998653,ISDB,SBENKNZHVXGNTP-UHFFFAOYSA-N,"InChI=1S/C11H14O3/c1-13-7-3-4-9-5-6-10(12)11(8-9)14-2/h3-6,8,12H,7H2,1-2H3",COCC=Cc1ccc(O)c(OC)c1,C11H14O3,,194.094294308,SBENKNZHVXGNTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Conioselinum anthriscoides,200246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Unknown'],['Ligusticum'],['Ligusticum sinense'],4,3,6.699461221694946 8379,950,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.2998653,ISDB,SBENKNZHVXGNTP-UHFFFAOYSA-N,"InChI=1S/C11H14O3/c1-13-7-3-4-9-5-6-10(12)11(8-9)14-2/h3-6,8,12H,7H2,1-2H3",COCC=Cc1ccc(O)c(OC)c1,C11H14O3,,194.094294308,SBENKNZHVXGNTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Aeschynanthus bracteatus,154188.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Gesneriaceae'],['Trichosporeae'],['Aeschynanthus'],['Aeschynanthus bracteatus'],4,3,6.699461221694946 8380,945,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,DRAPQDCEBKBPQE-ACFZRETJSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(13-4-6-16(29)18(8-13)34-2)26(14,11-36-23)38-25-22(32)21(31)20(30)19(9-27)37-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25+,26-/m1/s1",COc1cc([C@H]2OC[C@]3(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639999,DRAPQDCEBKBPQE,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 8381,945,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 8382,945,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,ORRYWOBRSQRASU-UHFFFAOYSA-N,"InChI=1S/C26H32O12/c1-33-17-7-12(3-5-15(17)28)23-14-10-35-24(26(14,32)11-36-23)13-4-6-16(18(8-13)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3",COc1cc(C2OCC3(O)C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,ORRYWOBRSQRASU,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,6.5 8383,945,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,GQLQVPZSTWXDBQ-ZOKOZUFBSA-N,"InChI=1S/C26H32O12/c1-33-17-8-13(3-5-15(17)28)24-26(32)11-36-23(14(26)10-35-24)12-4-6-16(18(7-12)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25-,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.1893764639998,GQLQVPZSTWXDBQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,1,6.5 8384,945,195,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acid amides,0.0,MS1_match,KPZWNZOLVDRTMM-YRDWWIAGSA-N,"InChI=1S/C26H32O12/c1-33-18-8-13(3-5-16(18)28)23-26(32)11-36-22(15(26)10-35-23)12-4-6-17(19(7-12)34-2)37-25-14(9-27)20(29)21(30)24(31)38-25/h3-8,14-15,20-25,27-32H,9-11H2,1-2H3/t14-,15-,20-,21+,22-,23-,24+,25+,26-/m1/s1",COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O[C@H]5O[C@H](O)[C@@H](O)[C@H](O)[C@H]5CO)c(OC)c4)OC[C@]23O)ccc1O,C26H32O12,pos_2_2proton2acetonitrile,536.189376464,KPZWNZOLVDRTMM,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Valeriana prionophylla,526653.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana prionophylla'],6,1,6.5 8385,944,449,Shikimates and Phenylpropanoids,Cyclic polyketides,Cinnamic acids and derivatives,0.0,MS1_match,RUVINXPYWBROJD-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3",CC=Cc1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8386,943,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.2659161,ISDB,SYYIRKGALNGKTB-UHFFFAOYSA-N,"InChI=1S/C12H14O3/c1-12(2)6-5-8-7-9(11(13)14)3-4-10(8)15-12/h3-4,7H,5-6H2,1-2H3,(H,13,14)",CC1(C)CCc2cc(C(=O)O)ccc2O1,C12H14O3,,206.094294308,SYYIRKGALNGKTB,Terpenoids,Meroterpenoids,Merohemiterpenoids,Sargentodoxa cuneata,639710.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Lardizabalaceae'],['Unknown'],['Sargentodoxa'],['Sargentodoxa cuneata'],5,1,6.563664436340332 8387,941,-1,,,,0.0,MS1_match,BSOROLZKYXGRJC-LVXXQJFHSA-N,"InChI=1S/C23H34N2O3/c1-4-21-10-16(28-3)23-13-8-12-6-7-22(27,18(13)17(12)20(24)26)14(9-15(21)23)19(23)25(5-2)11-21/h4,12-19,27H,1,5-11H2,2-3H3,(H2,24,26)/t12?,13?,14?,15?,16-,17?,18?,19?,21+,22-,23?/m0/s1",C=C[C@]12C[C@H](OC)C34C5CC6CC[C@](O)(C(CC31)C4N(CC)C2)C5C6C(N)=O,C23H34N2O3,pos_2MK,386.256942948,BSOROLZKYXGRJC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 8388,938,110,Fatty acids,Octadecanoids,Other Octadecanoids,0.7659935,ISDB,ACHDMUPTZYZIGR-JPAZTHTMSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3+,8-6+,14-11+",CC/C=C/C/C=C/C=C/C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,8.563973903656006 8389,938,110,Fatty acids,Octadecanoids,Other Octadecanoids,0.7659935,ISDB,ACHDMUPTZYZIGR-CUHSZNQNSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3-,8-6-,14-11+",CC/C=C\C/C=C\C=C\C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Isatis tinctoria,631500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Isatideae'],['Isatis'],['Isatis tinctoria'],4,3,8.563973903656006 8390,936,751,Fatty acids,Fatty Acids and Conjugates,Carbocyclic fatty acids,0.35327345,ISDB,KLBSBBUHUGIULX-UHFFFAOYSA-N,"InChI=1S/C28H46O4/c29-28(30)20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-25-21-22-26-27(23-25)32-24-31-26/h21-23H,1-20,24H2,(H,29,30)",O=C(O)CCCCCCCCCCCCCCCCCCCCc1ccc2c(c1)OCO2,C28H46O4,,446.339609952,KLBSBBUHUGIULX,Fatty acids,Fatty Acids and Conjugates,Carbocyclic fatty acids,Iryanthera juruensis,6028378.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Myristicaceae'],['Unknown'],['Iryanthera'],['Iryanthera juruensis'],4,3,6.91309380531311 8391,935,69,Terpenoids,Sesquiterpenoids,Furans,0.58029175,ISDB,CTLVRIOTFRWXKP-BGTYHANMSA-N,"InChI=1S/C18H28O/c1-13-7-6-8-16-17(13,4)11-9-14(2)18(16,5)12-10-15(3)19/h6-7,14,16H,1,8-12H2,2-5H3/t14-,16-,17+,18+/m1/s1",C=C1C=CC[C@H]2[C@@](C)(CCC(C)=O)[C@H](C)CC[C@@]12C,C18H28O,,260.214015516,CTLVRIOTFRWXKP,Terpenoids,Sesquiterpenoids,,Parentucellia latifolia,981066.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Orobanchaceae'],['Rhinantheae'],['Parentucellia'],['Parentucellia latifolia'],4,2,7.3211669921875 8392,934,-1,,,,0.26555225,ISDB,HZGGHVGIXDRDDH-AVUBCJKYSA-N,"InChI=1S/C26H36O11/c1-14-22(29)24(31)25(32)26(36-14)35-10-4-5-15-6-9-18(20(11-15)34-3)37-21(13-27)23(30)16-7-8-17(28)19(12-16)33-2/h6-9,11-12,14,21-32H,4-5,10,13H2,1-3H3/t14-,21-,22-,23+,24+,25+,26-/m0/s1",COc1cc([C@@H](O)[C@H](CO)Oc2ccc(CCCO[C@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O11,,524.2257619719998,HZGGHVGIXDRDDH,Shikimates and Phenylpropanoids,Lignans,Neolignans,Epimedium sagittatum,175143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium sagittatum'],4,0,5.0622090101242065 8393,931,-1,,,,0.45113072,ISDB,,,,,,,DOECPDAPQMNSHK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.8045228719711304 8394,926,109,Terpenoids,Diterpenoids,Estrane steroids,0.7518215,ISDB,SDJMNNDDHQWWJH-UXCAXZQLSA-N,"InChI=1S/C18H26O3/c1-16-6-5-14(20)8-12(16)4-7-17-9-13(2-3-15(16)17)18(21,10-17)11-19/h5-6,12-13,15,19,21H,2-4,7-11H2,1H3/t12-,13-,15+,16-,17+,18+/m1/s1",C[C@@]12C=CC(=O)C[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(CO)C3,C18H26O3,,290.188194692,SDJMNNDDHQWWJH,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Diplospora dubia,729058.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora dubia'],4,2,8.007286071777344 8395,925,-1,,,,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_sodium,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8396,925,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-UHFFFAOYSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O15,pos_1_sodium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8397,925,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-CTZRMUNLSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26-,27?/m0/s1",C[C@@H]1O[C@@H](O[C@H]2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_sodium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 8398,925,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-UHFFFAOYSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3",CC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)OC(CO)C(O)C2O)C(O)C(O)C1O,C27H30O15,pos_1_sodium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8399,925,-1,,,,0.0,MS1_match,SHPPXMGVUDNKLV-CTZRMUNLSA-N,"InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26-,27?/m0/s1",C[C@@H]1O[C@@H](O[C@H]2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_sodium,594.15847026,SHPPXMGVUDNKLV,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 8400,925,-1,,,,0.0,MS1_match,USNPULRDBDVJAO-YRBSALHSSA-O,"InChI=1S/C27H30O15/c1-9-19(32)21(34)23(36)26(39-9)38-8-18-20(33)22(35)24(37)27(42-18)41-17-7-12-14(30)5-11(28)6-16(12)40-25(17)10-2-3-13(29)15(31)4-10/h2-7,9,18-24,26-27,32-37H,8H2,1H3,(H3-,28,29,30,31)/p+1/t9-,18+,19-,20+,21-,22+,23+,24+,26+,27+/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c(O)cc(O)cc4[o+]c3-c3ccc(O)c(O)c3)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C27H31O15+,pos_1_sodium,595.16574671209,USNPULRDBDVJAO,Shikimates and Phenylpropanoids,Flavonoids,Anthocyanidins,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 8401,925,-1,,,,0.0,MS1_match,XDMJJZUUHWWITI-IPOZFMEPSA-N,"InChI=1S/C27H30O15/c28-8-17-20(32)22(34)24(36)26(41-17)38-9-18-21(33)23(35)25(37)27(42-18)39-12-5-13(30)19-14(31)7-15(40-16(19)6-12)10-1-3-11(29)4-2-10/h1-7,17-18,20-30,32-37H,8-9H2/t17-,18-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O15,pos_1_sodium,594.15847026,XDMJJZUUHWWITI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,0,7.0 8402,922,380,Terpenoids,Sesquiterpenoids,Germacrane sesquiterpenoids,0.2067141,ISDB,PTBKVVLMZYDRHF-CQSZACIVSA-N,"InChI=1S/C15H21ClO2/c1-9-6-11-12(7-15(2,3)14(11)18)13(8-17)10(9)4-5-16/h6,14,17-18H,4-5,7-8H2,1-3H3/t14-/m1/s1",Cc1cc2c(c(CO)c1CCCl)CC(C)(C)[C@@H]2O,C15H21ClO2,,268.123007592,PTBKVVLMZYDRHF,Terpenoids,Sesquiterpenoids,Illudalane sesquiterpenoids,Alcyonium antarcticum,566266.0,['Eukaryota'],['Metazoa'],['Cnidaria'],['Anthozoa'],['Alcyonacea'],['Alcyoniidae'],['Unknown'],['Alcyonium'],['Alcyonium antarcticum'],1,2,2.8268563747406006 8403,921,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.40969938,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Corbicula japonica,920654.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Venerida'],['Cyrenidae'],['Unknown'],['Corbicula'],['Corbicula japonica'],1,3,4.1387975215911865 8404,921,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.40969938,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Corbicula sandai,920655.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Venerida'],['Cyrenidae'],['Unknown'],['Corbicula'],['Corbicula sandai'],1,3,4.1387975215911865 8405,921,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.40969938,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Crassostrea gigas,987409.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Ostreida'],['Ostreidae'],['Unknown'],['Magallana'],['Magallana gigas'],1,3,4.1387975215911865 8406,921,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.40969938,ISDB,QOCBLJWPUILPNE-DGDOQUKGSA-N,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(43-40)28-39(40,10)42/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40-/m1/s1",CC1=C(C#C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O)C(C)(C)C[C@H](O)C1,C40H54O3,,582.407295588,QOCBLJWPUILPNE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Magallana gigas,987409.0,['Eukaryota'],['Metazoa'],['Mollusca'],['Bivalvia'],['Ostreida'],['Ostreidae'],['Unknown'],['Magallana'],['Magallana gigas'],1,3,4.1387975215911865 8407,920,174,Terpenoids,Apocarotenoids,Megastigmanes,0.5661211,ISDB,ROTRZDNJZBPLJO-MLONCLLVSA-N,"InChI=1S/C19H34O7/c1-10-5-8-14(21)19(3,4)12(10)7-6-11(2)25-18-17(24)16(23)15(22)13(9-20)26-18/h11,13-18,20-24H,5-9H2,1-4H3/t11-,13-,14-,15-,16+,17-,18-/m1/s1",CC1=C(CC[C@@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H](O)CC1,C19H34O7,,374.230453428,ROTRZDNJZBPLJO,Terpenoids,Apocarotenoids,Megastigmanes,Alangium platanifolium,414781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Cornaceae'],['Unknown'],['Alangium'],['Alangium platanifolium'],4,3,7.764484405517578 8408,918,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.7424225,ISDB,AKWQTMZJEBHXCZ-JTMDCHCZSA-N,"InChI=1S/C55H76N2O12/c1-26-31-14-15-32-33-13-11-29-17-37-44(45(65-9)49(29,7)52(33,63)23-40(60)51(31,32)25-66-54(26)41(61)21-46(3,4)68-54)57-36-16-28-10-12-30-34(48(28,6)20-38(36)56-37)18-39(59)50(8)35(30)19-43-53(50,64)27(2)55(67-43)42(62)22-47(5,24-58)69-55/h15,19,26-31,33-34,39,41-43,45,58-59,61-64H,10-14,16-18,20-25H2,1-9H3/t26-,27-,28-,29-,30+,31+,33-,34-,39+,41+,42+,43-,45-,47-,48-,49+,50+,51+,52+,53+,54+,55-/m0/s1",CO[C@H]1c2nc3c(nc2C[C@@H]2CC[C@H]4C5=CC[C@@H]6[C@H](C)[C@@]7(OC[C@]56C(=O)C[C@]4(O)[C@]21C)OC(C)(C)C[C@H]7O)C[C@@]1(C)[C@@H](CC[C@H]2C4=C[C@@H]5O[C@]6(O[C@](C)(CO)C[C@H]6O)[C@@H](C)[C@]5(O)[C@@]4(C)[C@H](O)C[C@@H]21)C3,C55H76N2O12,,956.539825872,AKWQTMZJEBHXCZ,,,,Cephalodiscus gilchristi,3659703.0,['Eukaryota'],['Metazoa'],['Hemichordata'],['Pterobranchia'],['Cephalodiscida'],['Cephalodiscidae'],['Unknown'],['Cephalodiscus'],['Cephalodiscus gilchristi'],1,0,3.9696900844573975 8409,917,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 8410,917,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 8411,917,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis aestivalis,585229.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis aestivalis'],6,0,6.0 8412,917,-1,,,,0.0,MS1_match,QJPCKAJTLHDNCS-KQDSFGJDSA-N,"InChI=1S/C23H34O5/c1-20-7-3-15(24)12-22(20,26)9-5-18-17(20)4-8-21(2)16(6-10-23(18,21)27)14-11-19(25)28-13-14/h11,15-18,24,26-27H,3-10,12-13H2,1-2H3/t15-,16-,17+,18-,20-,21-,22+,23+/m1/s1",C[C@]12CC[C@@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C23H34O5,pos_1_sodium,390.240624188,QJPCKAJTLHDNCS,Terpenoids,Steroids,Cardenolides,Adonis vernalis,693556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis vernalis'],6,0,6.0 8413,914,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.70356953,ISDB,LTUMRKDLVGQMJU-IUBLYSDUSA-N,"InChI=1S/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+",CC(=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C,C18H30O,,262.22966558,LTUMRKDLVGQMJU,Fatty acids,Fatty acyls,Fatty aldehydes,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,3,10.31427812576294 8414,913,-1,,,,0.0,MS1_match,XEOKATHZLYGOQV-GVODYPPYSA-N,"InChI=1S/C36H58O11/c1-16-12-17-27(31(4,5)43)47-36(46-17)26(16)32(6)10-11-34-15-35(34)19(8-9-20(34)33(32,7)29(36)42)30(2,3)22(13-21(35)38)45-28-25(41)24(40)23(39)18(14-37)44-28/h16-29,37-43H,8-15H2,1-7H3/t16-,17-,18-,19+,20-,21+,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34+,35-,36+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)C[C@H](O)[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C36H58O11,pos_1_1proton1ethylamine,666.397912676,XEOKATHZLYGOQV,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8415,913,-1,,,,0.0,MS1_match,XEOKATHZLYGOQV-GVODYPPYSA-N,"InChI=1S/C36H58O11/c1-16-12-17-27(31(4,5)43)47-36(46-17)26(16)32(6)10-11-34-15-35(34)19(8-9-20(34)33(32,7)29(36)42)30(2,3)22(13-21(35)38)45-28-25(41)24(40)23(39)18(14-37)44-28/h16-29,37-43H,8-15H2,1-7H3/t16-,17-,18-,19+,20-,21+,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34+,35-,36+/m1/s1",C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)C[C@H](O)[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13,C36H58O11,pos_1_1proton1ethylamine,666.397912676,XEOKATHZLYGOQV,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8416,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-HONGMTQGSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20+,21-,24+/m0/s1",O=C(O)CC(=O)OC[C@@H]1O[C@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Corchorus olitorius,578269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Malvaceae'],['Apeibeae'],['Corchorus'],['Corchorus olitorius'],4,3,9.342575788497925 8417,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-XTUREBQPSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14?,18-,20+,21-,24?/m1/s1",O=C(O)CC(=O)OCC1OC(Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Phyteuma orbiculare,743259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Campanulaceae'],['Unknown'],['Phyteuma'],['Phyteuma orbiculare'],4,3,9.342575788497925 8418,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-UJKBSQBPSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20+,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C24H22O15,,550.0958700039998,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rubus adenotrichos,3906459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rubus'],['Rubus adenotrichos'],4,3,9.342575788497925 8419,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-UJKBSQBPSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20+,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C24H22O15,,550.0958700039998,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rubus adenotrichus,3906459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rubus'],['Rubus adenotrichos'],4,3,9.342575788497925 8420,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-UJKBSQBPSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20+,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C24H22O15,,550.0958700039998,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rubus glaucus,896757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rubus'],['Rubus glaucus'],4,3,9.342575788497925 8421,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-NWFUCLLXSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20-,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,3,9.342575788497925 8422,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-NWFUCLLXSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20-,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,3,9.342575788497925 8423,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-NWFUCLLXSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20-,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,3,9.342575788497925 8424,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-UJKBSQBPSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20+,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C24H22O15,,550.0958700039998,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Smyrnium olusatrum,478994.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Smyrnieae'],['Smyrnium'],['Smyrnium olusatrum'],4,3,9.342575788497925 8425,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-NWFUCLLXSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20-,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Humulus lupulus,84020.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Humulus'],['Humulus lupulus'],4,3,9.342575788497925 8426,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-NWFUCLLXSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20-,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Salicornia depressa,245804.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia virginica'],4,3,9.342575788497925 8427,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-NWFUCLLXSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20-,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Salicornia maritima,1024331.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia maritima'],4,3,9.342575788497925 8428,912,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.96064395,ISDB,NBQPHANHNTWDML-NWFUCLLXSA-N,"InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20-,21-,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C24H22O15,,550.095870004,NBQPHANHNTWDML,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Salicornia europaea,138420.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Unknown'],['Salicornia'],['Salicornia europaea'],4,3,9.342575788497925 8429,911,-1,,,,0.7104341,ISDB,XSSDYIMYZONMBL-BZNQNGANSA-N,"InChI=1S/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-3-1-6(2-4-7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11-,13-/m1/s1",O=C(O)c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C13H16O8,,300.084517472,XSSDYIMYZONMBL,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Nandina domestica,297870.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Nandina'],['Nandina domestica'],5,0,7.841736316680908 8430,905,-1,,,,0.7105904,ISDB,WPNYKVVEDMUXTO-HWKANZROSA-N,"InChI=1S/C11H10O4/c1-13-11(12)5-3-8-2-4-9-10(6-8)15-7-14-9/h2-6H,7H2,1H3/b5-3+",COC(=O)/C=C/c1ccc2c(c1)OCO2,C11H10O4,,206.0579088,WPNYKVVEDMUXTO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Piper kwashoense,6030948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper kwashoense'],4,0,6.842361688613892 8431,905,-1,,,,0.7105904,ISDB,WPNYKVVEDMUXTO-HWKANZROSA-N,"InChI=1S/C11H10O4/c1-13-11(12)5-3-8-2-4-9-10(6-8)15-7-14-9/h2-6H,7H2,1H3/b5-3+",COC(=O)/C=C/c1ccc2c(c1)OCO2,C11H10O4,,206.0579088,WPNYKVVEDMUXTO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Piper philippinum,290828.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper nudibaccatum'],4,0,6.842361688613892 8432,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 8433,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 8434,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 8435,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 8436,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 8437,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 8438,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-VHNBHZRZSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,0,6.0 8439,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 8440,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 8441,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 8442,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 8443,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 8444,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 8445,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum monticola,625485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum monticola'],6,0,6.0 8446,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum campylorrhynchum,117075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum campylorrhynchum'],6,0,6.0 8447,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudostapfianum,1073593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tuguancunense'],6,0,6.0 8448,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,0,6.0 8449,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-IZGTZTBCSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13+,14+,15-,16-,17-,18+,19-,20+,21-,22-/m0/s1",CCN1C[C@@H]2CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum toxicum,5737811.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum toxicum'],6,0,6.0 8450,902,-1,,,,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum contortum,909683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum contortum'],6,0,6.0 8451,902,-1,,,,0.0,MS1_match,UIVVIYORXDFKKO-IGWUHLPXSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)6-5-16(25)22-14(19)9-13(17(22)23)20-7-4-12(8-15(20)22)21(27,11-24)18(20)26/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]12CC[C@@H](C[C@H]14)[C@@](O)(CO)[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,UIVVIYORXDFKKO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 8452,902,-1,,,,0.0,MS1_match,UIVVIYORXDFKKO-IGWUHLPXSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)6-5-16(25)22-14(19)9-13(17(22)23)20-7-4-12(8-15(20)22)21(27,11-24)18(20)26/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]12CC[C@@H](C[C@H]14)[C@@](O)(CO)[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,UIVVIYORXDFKKO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 8453,902,-1,,,,0.0,MS1_match,KEXOMXFRKYKFSR-UNIHHUBBSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)14-9-13-17(23)21(14,7-5-16(19)25)15-8-12-4-6-20(13,15)18(26)22(12,27)11-24/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)[C@H](O)CC[C@@]34[C@@H]5C[C@@H]6CC[C@]5([C@H](O)[C@]6(O)CO)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566086,KEXOMXFRKYKFSR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,0,6.0 8454,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 8455,902,-1,,,,0.0,MS1_match,HKGMHDMSESOCGT-YISBXEQFSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(27-3)22-12-7-11-14(24)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@H]6O)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKGMHDMSESOCGT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,0,6.0 8456,902,-1,,,,0.0,MS1_match,MDCQBGQVDRLEGB-SZDRHTRBSA-N,"InChI=1S/C22H35NO4/c1-4-23-11-19(2)7-6-15(27-3)22-14(19)9-13(18(22)23)20(25)8-5-12-10-21(22,26)17(20)16(12)24/h12-18,24-26H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17+,18+,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)CC[C@H]2C[C@]4(O)[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,MDCQBGQVDRLEGB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 8457,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 8458,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 8459,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-DSGMTPGBSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 8460,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium poltaratzkii,6131764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium poltaratzkii'],6,0,6.0 8461,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 8462,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,0,6.0 8463,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 8464,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 8465,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 8466,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 8467,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,0,6.0 8468,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 8469,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 8470,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-VHNBHZRZSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,0,6.0 8471,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 8472,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 8473,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 8474,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 8475,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 8476,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-DSGMTPGBSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 8477,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium poltaratzkii,6131764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium poltaratzkii'],6,0,6.0 8478,902,-1,,,,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_1_1proton1methanol,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 8479,901,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.35072777,ISDB,LZUMFOJNPXMVHE-FOAIJFERSA-N,"InChI=1S/C45H66O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-32,38-39,42-46,49-51H,3-4,9-10,15-16,21-22,27-28,33-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC,C45H66O10,,766.4655983119999,LZUMFOJNPXMVHE,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Heterocapsa circularisquama,817277.0,['Eukaryota'],['Unknown'],['Unknown'],['Dinophyceae'],['Peridiniales'],['Unknown'],['Unknown'],['Heterocapsa'],['Heterocapsa circularisquama'],1,0,2.402911067008972 8480,900,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.2971563,ISDB,ODRDPUNVAUMJOH-QFWMQHCXSA-N,"InChI=1S/C30H43N3O4/c1-10-29(5,6)26-22(16-23-28(36)31-18(4)27(35)32-23)21-14-19(12-11-17(2)3)13-20(25(21)33-26)15-24(34)30(7,8)37-9/h10-11,13-14,18,23-24,33-34H,1,12,15-16H2,2-9H3,(H,31,36)(H,32,35)/t18-,23-,24+/m1/s1",C=CC(C)(C)c1[nH]c2c(C[C@H](O)C(C)(C)OC)cc(CC=C(C)C)cc2c1C[C@H]1NC(=O)[C@@H](C)NC1=O,C30H43N3O4,,509.325356856,ODRDPUNVAUMJOH,Alkaloids,Peptide alkaloids,"Indole diketopiperazine alkaloids (L-Trp, L-Ala)",Aspergillus,550772.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Unknown'],1,0,2.18862521648407 8481,899,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,DBANWUMRYUJBKJ-SRUNSHPASA-N,"InChI=1S/C36H58O7/c1-20-26(37)27(38)28(39)29(42-20)43-25-12-13-33(6)23(32(25,4)5)11-14-35(8)24(33)10-9-21-22-19-31(2,3)15-17-36(22,30(40)41)18-16-34(21,35)7/h9,20,22-29,37-39H,10-19H2,1-8H3,(H,40,41)/t20-,22-,23-,24+,25-,26-,27+,28+,29-,33-,34+,35+,36-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O)[C@H](O)[C@H]1O,C36H58O7,pos_1_1sodium1acetonitrile,602.418254196,DBANWUMRYUJBKJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone narcissiflora,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,1,7.5 8482,899,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,DBANWUMRYUJBKJ-SRUNSHPASA-N,"InChI=1S/C36H58O7/c1-20-26(37)27(38)28(39)29(42-20)43-25-12-13-33(6)23(32(25,4)5)11-14-35(8)24(33)10-9-21-22-19-31(2,3)15-17-36(22,30(40)41)18-16-34(21,35)7/h9,20,22-29,37-39H,10-19H2,1-8H3,(H,40,41)/t20-,22-,23-,24+,25-,26-,27+,28+,29-,33-,34+,35+,36-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O)[C@H](O)[C@H]1O,C36H58O7,pos_1_1sodium1acetonitrile,602.418254196,DBANWUMRYUJBKJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemone multifida,896056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone multifida'],7,1,7.5 8483,899,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,DBANWUMRYUJBKJ-SRUNSHPASA-N,"InChI=1S/C36H58O7/c1-20-26(37)27(38)28(39)29(42-20)43-25-12-13-33(6)23(32(25,4)5)11-14-35(8)24(33)10-9-21-22-19-31(2,3)15-17-36(22,30(40)41)18-16-34(21,35)7/h9,20,22-29,37-39H,10-19H2,1-8H3,(H,40,41)/t20-,22-,23-,24+,25-,26-,27+,28+,29-,33-,34+,35+,36-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O)[C@H](O)[C@H]1O,C36H58O7,pos_1_1sodium1acetonitrile,602.418254196,DBANWUMRYUJBKJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Anemonastrum narcissiflorum,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,1,7.5 8484,898,238,Terpenoids,Triterpenoids,Friedelane triterpenoids,0.0,MS1_match,DPKBLLFCUGWECD-GTYQNAEWSA-N,"InChI=1S/C28H46O3/c1-18-19(29)7-8-20-24(18,3)10-9-21-25(20,4)12-13-27(6)22-17-23(2,30)11-15-28(22,31)16-14-26(21,27)5/h18,20-22,30-31H,7-17H2,1-6H3/t18-,20+,21-,22-,23+,24+,25-,26+,27-,28-/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)CC[C@]3(O)CC[C@]12C,C28H46O3,pos_1_sodium,430.344695332,DPKBLLFCUGWECD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,3,8.5 8485,897,-1,,,,0.7761064,ISDB,,,,,,,OLNJKAXRBXUBTB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.1044256687164307 8486,894,-1,,,,0.4229482,ISDB,CIIDMMPURFCERH-OWVRDFCESA-N,"InChI=1S/C22H36O4/c1-14(24)26-18-10-17-19(2,13-23)8-5-9-20(17,3)16-7-6-15-11-22(16,18)12-21(15,4)25/h15-18,23,25H,5-13H2,1-4H3/t15-,16+,17-,18+,19-,20+,21-,22-/m1/s1",CC(=O)O[C@H]1C[C@@H]2[C@@](C)(CO)CCC[C@@]2(C)[C@@H]2CC[C@@H]3C[C@]12C[C@@]3(C)O,C22H36O4,,364.261359632,CIIDMMPURFCERH,Terpenoids,Diterpenoids,Kaurane and Phyllocladane diterpenoids,Sideritis congesta,6081606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Stachydeae'],['Sideritis'],['Sideritis congesta'],4,0,5.691792845726013 8487,893,-1,,,,0.0,MS1_match,MNWFXJYAOYHMED-UHFFFAOYSA-N,"InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)",CCCCCCC(=O)O,C7H14O2,pos_1_1proton1methanol,130.099379688,MNWFXJYAOYHMED,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 8488,893,-1,,,,0.0,MS1_match,MNWFXJYAOYHMED-UHFFFAOYSA-N,"InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)",CCCCCCC(=O)O,C7H14O2,pos_1_1proton1methanol,130.099379688,MNWFXJYAOYHMED,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 8489,888,1117,Polyketides,Sesquiterpenoids,Valerenane sesquiterpenoids,0.0,MS1_match,GMTBKCJRMNJNFL-UHFFFAOYSA-N,"InChI=1S/C17H26O2/c1-11(10-19-14(4)18)9-15-7-5-12(2)16-8-6-13(3)17(15)16/h9,12,15-16H,5-8,10H2,1-4H3",CC(=O)OCC(C)=CC1CCC(C)C2CCC(C)=C12,C17H26O2,pos_1_1proton1methanol,262.193280072,GMTBKCJRMNJNFL,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 8490,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-MQNNAEJASA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17-,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,3,7.5 8491,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 8492,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3",CC1OC(Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O,C21H20O10,pos_1_sodium,432.1056468399998,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 8493,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-MQNNAEJASA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17-,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium formosum,3944990.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium formosum'],6,3,7.5 8494,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-GKLNBGJFSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C21H20O10,pos_1_sodium,432.10564684,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum vulparia,5511358.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 8495,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,HQNOUCSPWAGQND-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3",CC1OC(Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O,C21H20O10,pos_1_sodium,432.1056468399998,HQNOUCSPWAGQND,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 8496,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,PMWOCSJXZDDAPR-IARDODDQSA-N,"InChI=1S/C21H20O10/c1-8(22)19-17(27)18(28)21(31-19)29-11-6-12(24)14-13(7-11)30-20(16(26)15(14)25)9-2-4-10(23)5-3-9/h2-8,17-19,21-24,26-28H,1H3/t8-,17-,18+,19+,21+/m0/s1",C[C@H](O)[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H]1O,C21H20O10,pos_1_sodium,432.1056468399998,PMWOCSJXZDDAPR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,3,7.5 8497,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,PMWOCSJXZDDAPR-IARDODDQSA-N,"InChI=1S/C21H20O10/c1-8(22)19-17(27)18(28)21(31-19)29-11-6-12(24)14-13(7-11)30-20(16(26)15(14)25)9-2-4-10(23)5-3-9/h2-8,17-19,21-24,26-28H,1H3/t8-,17-,18+,19+,21+/m0/s1",C[C@H](O)[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H]1O,C21H20O10,pos_1_sodium,432.1056468399998,PMWOCSJXZDDAPR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,3,7.5 8498,884,1042,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Flavonols,0.0,MS1_match,OBPMSXUPNDBUII-GLYWERGQSA-N,"InChI=1S/C21H20O10/c1-8-15(24)20(28)31-21(16(8)25)29-11-6-12(23)14-13(7-11)30-19(18(27)17(14)26)9-2-4-10(22)5-3-9/h2-8,15-16,20-25,27-28H,1H3/t8-,15-,16-,20-,21-/m1/s1",C[C@@H]1[C@@H](O)[C@H](O)O[C@@H](Oc2cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4)oc3c2)[C@@H]1O,C21H20O10,pos_1_sodium,432.10564684,OBPMSXUPNDBUII,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,3,7.5 8499,881,592,Fatty acids,Fatty acyls,Fatty ethers,0.54588467,ISDB,ZHADMZSKNJUERU-BWLZIVRNSA-N,"InChI=1S/C19H30O3/c1-3-4-5-6-8-11-14-17-22-18-15-12-9-7-10-13-16-19(20)21-2/h4-5,8,11,14-15,17-18H,3,6-7,9-10,12-13,16H2,1-2H3/b5-4-,11-8-,17-14+,18-15+",CC/C=C\C/C=C\C=C\O/C=C/CCCCCCC(=O)OC,C19H30O3,,306.21949482,ZHADMZSKNJUERU,Fatty acids,Fatty acyls,Fatty ethers,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,7.6835386753082275 8500,877,86,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.7814368,ISDB,PMRJYBALQVLLSJ-UHFFFAOYSA-N,"InChI=1S/C13H16/c1-3-11-5-4-6-12-8-7-10(2)13(12)9-11/h4-6,9H,3,7-8H2,1-2H3",CCC1=CC2=C(C)CCC2=CC=C1,C13H16,,172.125200512,PMRJYBALQVLLSJ,,,,Stevia serrata,553390.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Stevia'],['Stevia serrata'],4,0,7.125747203826904 8501,875,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.43387404,ISDB,PZNXWOJHEGLWBY-UHFFFAOYSA-N,"InChI=1S/C30H33NO6/c1-15-11-29-12-19(33)24-28(3)14-31(4)25-22(29)23(34)18(15)10-21(29)30(24,25)13-20(36-16(2)32)26(28)37-27(35)17-8-6-5-7-9-17/h5-9,18,20-22,24-26H,1,10-14H2,2-4H3",C=C1CC23CC(=O)C4C5(C)CN(C)C6C2C(=O)C1CC3C64CC(OC(C)=O)C5OC(=O)c1ccccc1,C30H33NO6,,503.230787776,PZNXWOJHEGLWBY,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum contortum,909683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum contortum'],4,1,6.235496163368225 8502,875,153,Alkaloids,Monoterpenoids,Iridoids monoterpenoids,0.43387404,ISDB,PZNXWOJHEGLWBY-UHFFFAOYSA-N,"InChI=1S/C30H33NO6/c1-15-11-29-12-19(33)24-28(3)14-31(4)25-22(29)23(34)18(15)10-21(29)30(24,25)13-20(36-16(2)32)26(28)37-27(35)17-8-6-5-7-9-17/h5-9,18,20-22,24-26H,1,10-14H2,2-4H3",C=C1CC23CC(=O)C4C5(C)CN(C)C6C2C(=O)C1CC3C64CC(OC(C)=O)C5OC(=O)c1ccccc1,C30H33NO6,,503.230787776,PZNXWOJHEGLWBY,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],4,1,6.235496163368225 8503,874,72,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.33729574,ISDB,OVSVTCFNLSGAMM-UZFNGAIXSA-N,"InChI=1S/C40H62/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15,19-22,25,27-30H,13-14,16-18,23-24,26,31-32H2,1-10H3/b12-11?,25-15+,35-21+,36-22?,37-27?,38-28?,39-29?,40-30?",CC(C)=CCCC(C)=CCCC(C)=C/C=C/C(C)=C/C=CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C,C40H62,,542.485151984,OVSVTCFNLSGAMM,Terpenoids,Carotenoids (C40),"Carotenoids (C40, Ψ-Ψ)",Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,1,7.849182963371277 8504,873,-1,,,,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_sodium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 8505,873,-1,,,,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_sodium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 8506,872,-1,,,,0.0,MS1_match,DSNCQKUYZOSARM-QVLXMGEUSA-N,"InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(22-10)23-11(18)6-3-8-1-4-9(17)5-2-8/h1-6,10,12-17,19-21H,7H2/b6-3+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O8,pos_1_1potassium,326.1001675359999,DSNCQKUYZOSARM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8507,872,-1,,,,0.0,MS1_match,DSNCQKUYZOSARM-QVLXMGEUSA-N,"InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(22-10)23-11(18)6-3-8-1-4-9(17)5-2-8/h1-6,10,12-17,19-21H,7H2/b6-3+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O8,pos_1_1potassium,326.1001675359999,DSNCQKUYZOSARM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8508,870,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,SGUOENJPMRQEMJ-PLNGHNRSSA-N,"InChI=1S/C19H34O9/c1-10(21)5-6-19(26)17(2,3)7-11(8-18(19,4)25)27-16-15(24)14(23)13(22)12(9-20)28-16/h5-6,10-16,20-26H,7-9H2,1-4H3/t10-,11-,12-,13-,14+,15-,16-,18+,19+/m1/s1",C[C@@H](O)C=C[C@]1(O)C(C)(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@]1(C)O,C19H34O9,pos_1_1potassium,406.220282668,SGUOENJPMRQEMJ,Terpenoids,Apocarotenoids,Megastigmanes,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,2,7.0 8509,870,225,Terpenoids,Apocarotenoids,Polyprenylated cyclic polyketides (Hop meroterpenoids),0.0,MS1_match,FCSXIFYRVMQLAX-HPMNXYLDSA-N,"InChI=1S/C19H34O9/c1-10-6-12(7-18(2,3)19(10,26)5-4-11(22)8-20)27-17-16(25)15(24)14(23)13(9-21)28-17/h4-5,10-17,20-26H,6-9H2,1-3H3/b5-4+/t10-,11+,12+,13-,14+,15+,16-,17-,19-/m1/s1",C[C@@H]1C[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@@]1(O)/C=C/[C@H](O)CO,C19H34O9,pos_1_1potassium,406.220282668,FCSXIFYRVMQLAX,Terpenoids,Apocarotenoids,Megastigmanes,Monteverdia ilicifolia,433235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Monteverdia'],['Monteverdia ilicifolia'],6,2,7.0 8510,868,784,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,0.36147094,ISDB,TZHMUUDTNYTFMW-AVQMFFATSA-N,"InChI=1S/C23H32O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(25)20(24)18-21(23(19)26)27-4-2/h3,6-7,9-10,18,25H,1,4-5,8,11-17H2,2H3/b7-6+,10-9+",C=CC/C=C/C/C=C/CCCCCCCC1=C(O)C(=O)C=C(OCC)C1=O,C23H32O4,,372.230059504,TZHMUUDTNYTFMW,Polyketides,Aromatic polyketides,Aromatic polyketides with side chains,Sorghum bicolor,552986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Andropogoneae'],['Sorghum'],['Sorghum bicolor'],4,3,6.945883750915527 8511,867,-1,,,,0.0,MS1_match,DYFUVQSGLMQLRX-ALBXZGMBSA-N,"InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O10,pos_2_2sodium,648.387347992,DYFUVQSGLMQLRX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,0,7.0 8512,867,-1,,,,0.0,MS1_match,DYFUVQSGLMQLRX-ALBXZGMBSA-N,"InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H56O10,pos_2_2sodium,648.387347992,DYFUVQSGLMQLRX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Lonicera nigra,179065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera nigra'],7,0,7.0 8513,866,603,Fatty acids,Octadecanoids,Jasmonic acids,0.20791006,ISDB,,,,,,,QBINHQHKQOSSSV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8316402435302734 8514,864,1373,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.3797298,ISDB,WRNYMVWAPLPFJG-RQJABVFESA-N,"InChI=1S/C14H22O3/c1-9(15)10-7-11-13(2,12(16)8-10)5-4-6-14(11,3)17/h8,11-12,16-17H,4-7H2,1-3H3/t11-,12+,13-,14+/m1/s1",CC(=O)C1=C[C@H](O)[C@]2(C)CCC[C@](C)(O)[C@@H]2C1,C14H22O3,,238.156894564,WRNYMVWAPLPFJG,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Teucrium heterophyllum,5232637.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Teucrium'],['Teucrium heterophyllum'],4,3,7.018919229507446 8515,863,584,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,MYCMVOHQQRQCOM-ODXNCKRGSA-N,"InChI=1S/C27H38O13/c1-4-15-16(5-6-35-13(3)29)18(25(34)38-19-7-14-8-21(30)36-10-17(14)12(19)2)11-37-26(15)40-27-24(33)23(32)22(31)20(9-28)39-27/h4,11-12,14-17,19-20,22-24,26-28,31-33H,1,5-10H2,2-3H3/t12-,14-,15+,16+,17-,19+,20-,22-,23+,24-,26+,27+/m1/s1",C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3CC(=O)OC[C@@H]3[C@H]2C)[C@H]1CCOC(C)=O,C27H38O13,pos_1_1proton1ammonium,570.231241276,MYCMVOHQQRQCOM,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Abelia chinensis,589178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Abelia'],['Abelia chinensis'],6,3,7.5 8516,863,584,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RYNMWHZLOPICQA-SCWHPQJBSA-N,"InChI=1S/C27H38O13/c1-10-4-5-12-15(9-37-26(18(10)12)40-27-22(31)21(30)20(29)17(7-28)39-27)23(32)38-16-6-13-14(11(16)2)8-36-25(34)19(13)24(33)35-3/h9-14,16-22,26-31H,4-8H2,1-3H3/t10-,11+,12+,13-,14+,16-,17+,18-,19-,20+,21-,22+,26-,27-/m0/s1",COC(=O)[C@H]1C(=O)OC[C@@H]2[C@@H](C)[C@@H](OC(=O)C3=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]4[C@@H]3CC[C@@H]4C)C[C@H]12,C27H38O13,pos_1_1proton1ammonium,570.2312412759999,RYNMWHZLOPICQA,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Dipsacus laciniatus,489131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus laciniatus'],6,3,7.5 8517,862,-1,,,,0.424951,ISDB,XLWLLHXGWCWQSW-BUFZCUASSA-N,"InChI=1S/C18H24O6/c1-17(2)12-6-11(19)18(7-24-12)10-4-3-8(16(22)23)5-9(10)13(20)14(21)15(17)18/h8-10,12,14-15,21H,3-7H2,1-2H3,(H,22,23)/t8-,9-,10-,12-,14-,15-,18-/m1/s1",CC1(C)[C@H]2[C@H](O)C(=O)[C@@H]3C[C@H](C(=O)O)CC[C@H]3[C@@]23CO[C@@H]1CC3=O,C18H24O6,,336.15728848799995,XLWLLHXGWCWQSW,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Isodon eriocalyx,1067788.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Ocimeae'],['Isodon'],['Isodon eriocalyx'],4,0,5.699803948402405 8518,860,-1,,,,0.4398065,ISDB,NCYCYZXNIZJOKI-OVSJKPMPSA-N,"InChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,15H,7,10,14H2,1-5H3/b9-6+,12-11+,16-8+,17-13+",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CCC1,C20H28O,,284.214015516,NCYCYZXNIZJOKI,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,0,5.759225964546204 8519,860,-1,,,,0.4398065,ISDB,NCYCYZXNIZJOKI-OVSJKPMPSA-N,"InChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,15H,7,10,14H2,1-5H3/b9-6+,12-11+,16-8+,17-13+",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CCC1,C20H28O,,284.214015516,NCYCYZXNIZJOKI,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,0,5.759225964546204 8520,858,-1,,,,0.0,MS1_match,JOZKFWLRHCDGJA-LLVKDONJSA-N,"InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3/t11-/m1/s1",CC(=O)OCC[C@H](C)CCC=C(C)C,C12H22O2,pos_1_1proton1ammonium,198.161979944,JOZKFWLRHCDGJA,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8521,857,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.81696707,ISDB,LUGJNXFXIGAHTI-SPDAVFANSA-N,"InChI=1S/C36H36O19/c37-12-25-34(55-27(44)6-2-14-1-4-17(38)19(40)7-14)31(47)33(49)35(53-25)50-13-26-29(45)30(46)32(48)36(54-26)51-16-9-21(42)28-22(43)11-23(52-24(28)10-16)15-3-5-18(39)20(41)8-15/h1-11,25-26,29-42,45-49H,12-13H2/b6-2+/t25-,26-,29-,30+,31-,32-,33-,34-,35-,36-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)[C@H](O)[C@@H](O)[C@@H]2O)O[C@@H]1CO,C36H36O19,,772.185078932,LUGJNXFXIGAHTI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],8,3,12.767868280410767 8522,856,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QJVXKWHHAMZTBY-GCPOEHJPSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3+/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C/CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_1proton1acetonitrile,372.142032348,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 8523,856,582,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QJVXKWHHAMZTBY-GCPOEHJPSA-N,"InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3+/t12-,13-,14+,15-,17+/m1/s1",COc1cc(/C=C/CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C17H24O9,pos_1_1proton1acetonitrile,372.142032348,QJVXKWHHAMZTBY,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 8524,854,-1,,,,0.40163144,ISDB,,,,,,,AEOPOJXVDKIMSQ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6065257787704468 8525,853,-1,,,,0.0,MS1_match,ODBRNZZJSYPIDI-VJXVFPJBSA-N,"InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O11,pos_1_sodium,448.10056145999977,ODBRNZZJSYPIDI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 8526,853,-1,,,,0.0,MS1_match,ODBRNZZJSYPIDI-VJXVFPJBSA-N,"InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O11,pos_1_sodium,448.10056145999977,ODBRNZZJSYPIDI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,0,8.0 8527,853,-1,,,,0.0,MS1_match,JPUKWEQWGBDDQB-QSOFNFLRSA-N,"InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C21H20O11,pos_1_sodium,448.10056146,JPUKWEQWGBDDQB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 8528,853,-1,,,,0.0,MS1_match,JPUKWEQWGBDDQB-QSOFNFLRSA-N,"InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C21H20O11,pos_1_sodium,448.10056146,JPUKWEQWGBDDQB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 8529,853,-1,,,,0.0,MS1_match,JPUKWEQWGBDDQB-QSOFNFLRSA-N,"InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C21H20O11,pos_1_sodium,448.10056146,JPUKWEQWGBDDQB,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 8530,852,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.40075904,ISDB,PENUWXDRGVMHGY-BRSBDYLESA-N,"InChI=1S/C20H36O6/c1-3-5-7-9-17-11-15(21)13-20(24)26-18(10-8-6-4-2)12-16(22)14-19(23)25-17/h15-18,21-22H,3-14H2,1-2H3/t15-,16-,17-,18-/m1/s1",CCCCC[C@@H]1C[C@@H](O)CC(=O)O[C@H](CCCCC)C[C@@H](O)CC(=O)O1,C20H36O6,,372.2511888719999,PENUWXDRGVMHGY,Polyketides,,,Verbascum undulatum,6075297.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Verbascum'],['Verbascum undulatum'],4,0,5.603036165237427 8531,850,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NRVPTPWNYPSGNM-HDQOFMJGSA-N,"InChI=1S/C21H25NO5/c1-9-5-20-12-4-11(9)14(24)13(20)16-21(12)7-10(23)6-19(2,8-22(16)3)15(21)17(25)27-18(20)26/h11-16,24H,1,4-8H2,2-3H3/t11-,12+,13+,14-,15+,16-,19-,20+,21-/m0/s1",C=C1C[C@]23C(=O)OC(=O)[C@@H]4[C@@]5(C)CC(=O)C[C@@]46[C@H]([C@H]2[C@@H](O)[C@H]1C[C@H]36)N(C)C5,C21H25NO5,pos_1_1proton1dmso,371.1732729,NRVPTPWNYPSGNM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,3,7.5 8532,850,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NRVPTPWNYPSGNM-PBNMYXCRSA-N,"InChI=1S/C21H25NO5/c1-9-5-20-12-4-11(9)14(24)13(20)16-21(12)7-10(23)6-19(2,8-22(16)3)15(21)17(25)27-18(20)26/h11-16,24H,1,4-8H2,2-3H3/t11-,12+,13+,14+,15+,16-,19-,20+,21+/m0/s1",C=C1C[C@]23C(=O)OC(=O)[C@@H]4[C@@]5(C)CC(=O)C[C@]46[C@H]([C@H]2[C@H](O)[C@H]1C[C@H]36)N(C)C5,C21H25NO5,pos_1_1proton1dmso,371.1732728999999,NRVPTPWNYPSGNM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium halteratum,209854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium halteratum'],6,3,7.5 8533,850,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NRVPTPWNYPSGNM-HDQOFMJGSA-N,"InChI=1S/C21H25NO5/c1-9-5-20-12-4-11(9)14(24)13(20)16-21(12)7-10(23)6-19(2,8-22(16)3)15(21)17(25)27-18(20)26/h11-16,24H,1,4-8H2,2-3H3/t11-,12+,13+,14-,15+,16-,19-,20+,21-/m0/s1",C=C1C[C@]23C(=O)OC(=O)[C@@H]4[C@@]5(C)CC(=O)C[C@@]46[C@H]([C@H]2[C@@H](O)[C@H]1C[C@H]36)N(C)C5,C21H25NO5,pos_1_1proton1dmso,371.1732729,NRVPTPWNYPSGNM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium verdunense,142827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium verdunense'],6,3,7.5 8534,850,961,Shikimates and Phenylpropanoids,Tyrosine alkaloids,Terpenoid alkaloids,0.0,MS1_match,NRVPTPWNYPSGNM-PBNMYXCRSA-N,"InChI=1S/C21H25NO5/c1-9-5-20-12-4-11(9)14(24)13(20)16-21(12)7-10(23)6-19(2,8-22(16)3)15(21)17(25)27-18(20)26/h11-16,24H,1,4-8H2,2-3H3/t11-,12+,13+,14+,15+,16-,19-,20+,21+/m0/s1",C=C1C[C@]23C(=O)OC(=O)[C@@H]4[C@@]5(C)CC(=O)C[C@]46[C@H]([C@H]2[C@H](O)[C@H]1C[C@H]36)N(C)C5,C21H25NO5,pos_1_1proton1dmso,371.1732728999999,NRVPTPWNYPSGNM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium halteratum,209854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium halteratum'],6,3,7.5 8535,849,174,Terpenoids,Apocarotenoids,Megastigmanes,0.54325795,ISDB,QWCOEYNCDIXGMI-FWANMBCFSA-N,"InChI=1S/C24H42O11/c1-13-6-5-8-22(3,4)24(13,31)9-7-14(2)34-20-18(28)17(27)16(26)15(35-20)10-32-21-19(29)23(30,11-25)12-33-21/h6,14-21,25-31H,5,7-12H2,1-4H3/t14-,15-,16-,17+,18-,19+,20+,21-,23-,24-/m1/s1",CC1=CCCC(C)(C)[C@@]1(O)CC[C@@H](C)O[C@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H42O11,,506.272712164,QWCOEYNCDIXGMI,Terpenoids,Apocarotenoids,Megastigmanes,Cydonia oblonga,941743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Cydonia'],['Cydonia oblonga'],4,3,7.673031806945801 8536,849,174,Terpenoids,Apocarotenoids,Megastigmanes,0.54325795,ISDB,QWCOEYNCDIXGMI-FWANMBCFSA-N,"InChI=1S/C24H42O11/c1-13-6-5-8-22(3,4)24(13,31)9-7-14(2)34-20-18(28)17(27)16(26)15(35-20)10-32-21-19(29)23(30,11-25)12-33-21/h6,14-21,25-31H,5,7-12H2,1-4H3/t14-,15-,16-,17+,18-,19+,20+,21-,23-,24-/m1/s1",CC1=CCCC(C)(C)[C@@]1(O)CC[C@@H](C)O[C@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C24H42O11,,506.272712164,QWCOEYNCDIXGMI,Terpenoids,Apocarotenoids,Megastigmanes,Cydonia vulgaris,316549.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Chaenomeles'],['Chaenomeles sinensis'],4,3,7.673031806945801 8537,848,662,,,,0.2351732,ISDB,,,,,,,IGXTWIXUKNUILL,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9406927824020386 8538,847,-1,,,,0.2702922,ISDB,AKZBEMDOKOHIFM-BIGSBDRZSA-N,"InChI=1S/C24H20O9/c25-14-3-1-10(5-16(14)27)12-8-21(31)33-24-13-7-19(30)23(11-2-4-15(26)17(28)6-11)32-20(13)9-18(29)22(12)24/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19-,23+/m0/s1",O=C1C[C@@H](c2ccc(O)c(O)c2)c2c(O)cc3c(c2O1)C[C@H](O)[C@@H](c1ccc(O)c(O)c1)O3,C24H20O9,,452.11073221999993,AKZBEMDOKOHIFM,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Flacourtia indica,215655.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Salicaceae'],['Flacourtieae'],['Flacourtia'],['Flacourtia indica'],4,0,5.0811687707901 8539,847,-1,,,,0.2702922,ISDB,AKZBEMDOKOHIFM-MSVHQQNVSA-N,"InChI=1S/C24H20O9/c25-14-3-1-10(5-16(14)27)12-8-21(31)33-24-13-7-19(30)23(11-2-4-15(26)17(28)6-11)32-20(13)9-18(29)22(12)24/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19+,23-/m1/s1",O=C1C[C@H](c2ccc(O)c(O)c2)c2c(O)cc3c(c2O1)C[C@H](O)[C@@H](c1ccc(O)c(O)c1)O3,C24H20O9,,452.11073222,AKZBEMDOKOHIFM,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Castanopsis hystrix,129485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Castanopsis'],['Castanopsis hystrix'],4,0,5.0811687707901 8540,847,-1,,,,0.2702922,ISDB,AKZBEMDOKOHIFM-MSVHQQNVSA-N,"InChI=1S/C24H20O9/c25-14-3-1-10(5-16(14)27)12-8-21(31)33-24-13-7-19(30)23(11-2-4-15(26)17(28)6-11)32-20(13)9-18(29)22(12)24/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19+,23-/m1/s1",O=C1C[C@H](c2ccc(O)c(O)c2)c2c(O)cc3c(c2O1)C[C@H](O)[C@@H](c1ccc(O)c(O)c1)O3,C24H20O9,,452.11073222,AKZBEMDOKOHIFM,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Castanopsis purpurella,3930380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Castanopsis'],['Castanopsis purpurella'],4,0,5.0811687707901 8541,847,-1,,,,0.2702922,ISDB,AKZBEMDOKOHIFM-MSVHQQNVSA-N,"InChI=1S/C24H20O9/c25-14-3-1-10(5-16(14)27)12-8-21(31)33-24-13-7-19(30)23(11-2-4-15(26)17(28)6-11)32-20(13)9-18(29)22(12)24/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19+,23-/m1/s1",O=C1C[C@H](c2ccc(O)c(O)c2)c2c(O)cc3c(c2O1)C[C@H](O)[C@@H](c1ccc(O)c(O)c1)O3,C24H20O9,,452.11073222,AKZBEMDOKOHIFM,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Smilax corbularia,628572.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Liliales'],['Smilacaceae'],['Unknown'],['Smilax'],['Smilax corbularia'],4,0,5.0811687707901 8542,847,-1,,,,0.2702922,ISDB,AKZBEMDOKOHIFM-UMAWSMADSA-N,"InChI=1S/C24H20O9/c25-14-3-1-10(5-16(14)27)12-8-21(31)33-24-13-7-19(30)23(11-2-4-15(26)17(28)6-11)32-20(13)9-18(29)22(12)24/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19-,23-/m1/s1",O=C1C[C@H](c2ccc(O)c(O)c2)c2c(O)cc3c(c2O1)C[C@@H](O)[C@@H](c1ccc(O)c(O)c1)O3,C24H20O9,,452.11073222,AKZBEMDOKOHIFM,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Trichilia catigua,5747805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Trichilia'],['Trichilia catigua'],4,0,5.0811687707901 8543,847,-1,,,,0.2702922,ISDB,AKZBEMDOKOHIFM-UMAWSMADSA-N,"InChI=1S/C24H20O9/c25-14-3-1-10(5-16(14)27)12-8-21(31)33-24-13-7-19(30)23(11-2-4-15(26)17(28)6-11)32-20(13)9-18(29)22(12)24/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19-,23-/m1/s1",O=C1C[C@H](c2ccc(O)c(O)c2)c2c(O)cc3c(c2O1)C[C@@H](O)[C@@H](c1ccc(O)c(O)c1)O3,C24H20O9,,452.11073222,AKZBEMDOKOHIFM,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Cinchona pubescens,30634.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Cinchoneae'],['Cinchona'],['Cinchona pubescens'],4,0,5.0811687707901 8544,847,-1,,,,0.2702922,ISDB,AKZBEMDOKOHIFM-MSVHQQNVSA-N,"InChI=1S/C24H20O9/c25-14-3-1-10(5-16(14)27)12-8-21(31)33-24-13-7-19(30)23(11-2-4-15(26)17(28)6-11)32-20(13)9-18(29)22(12)24/h1-6,9,12,19,23,25-30H,7-8H2/t12-,19+,23-/m1/s1",O=C1C[C@H](c2ccc(O)c(O)c2)c2c(O)cc3c(c2O1)C[C@H](O)[C@@H](c1ccc(O)c(O)c1)O3,C24H20O9,,452.11073222,AKZBEMDOKOHIFM,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Castanopsis sclerophylla,149021.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Fagaceae'],['Unknown'],['Castanopsis'],['Castanopsis sclerophylla'],4,0,5.0811687707901 8545,846,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.70533985,ISDB,YAMUFBLWGFFICM-PTGWMXDISA-N,"InChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/b13-12-/t25-/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H52NO7P,,521.348139634,YAMUFBLWGFFICM,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,3,5.321359395980835 8546,845,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.4786363,ISDB,OCLUXIQGSXDQNA-WCQYABFASA-N,"InChI=1S/C13H16O3/c1-13-5-4-9-10(7-16-12(9)15)11(13)3-2-8(14)6-13/h11H,2-7H2,1H3/t11-,13+/m0/s1",C[C@]12CCC3=C(COC3=O)[C@@H]1CCC(=O)C2,C13H16O3,,220.109944372,OCLUXIQGSXDQNA,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,9.414545178413391 8547,844,1111,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.5333624,ISDB,PYTRVKJKYCINDC-KBPBESRZSA-N,"InChI=1S/C14H20O3/c1-8(2)9-4-5-11(15)10-6-7-14(3,17)13(16)12(9)10/h4-5,8,13,15-17H,6-7H2,1-3H3/t13-,14-/m0/s1",CC(C)c1ccc(O)c2c1[C@H](O)[C@@](C)(O)CC2,C14H20O3,,236.1412445,PYTRVKJKYCINDC,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Alpinia oxyphylla,144287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Alpinia'],['Alpinia oxyphylla'],4,3,7.633449554443359 8548,842,-1,,,,0.0,MS1_match,VNDMFSADMLFAMF-UHFFFAOYSA-N,"InChI=1S/C22H29NO6/c1-10-6-21(19(28)29-4)13-5-12(10)15(25)14(21)17-22(13)8-11(24)7-20(2,9-23(17)3)16(22)18(26)27/h11-14,16-17,24H,1,5-9H2,2-4H3,(H,26,27)",C=C1CC2(C(=O)OC)C3C(=O)C1CC2C12CC(O)CC(C)(CN(C)C31)C2C(=O)O,C22H29NO6,pos_1_1proton1methanol,403.199487648,VNDMFSADMLFAMF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 8549,841,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NLMURPQWNRGYTM-OGGREQCXSA-N,"InChI=1S/C30H34O16/c31-12-19-23(36)25(38)28(41)30(44-19)46-22(35)10-5-15-3-8-17(33)18(11-15)43-29-27(40)26(39)24(37)20(45-29)13-42-21(34)9-4-14-1-6-16(32)7-2-14/h1-11,19-20,23-33,36-41H,12-13H2/b9-4+,10-5+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2cc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O16,pos_2_1proton1sodium,650.1846850080001,NLMURPQWNRGYTM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8550,841,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,HFIRFUKEPOQTLQ-KTFGOVRASA-N,"InChI=1S/C30H34O16/c31-12-19-23(36)25(38)28(41)30(44-19)46-22(35)10-4-14-1-6-16(7-2-14)43-29-27(40)26(39)24(37)20(45-29)13-42-21(34)9-5-15-3-8-17(32)18(33)11-15/h1-11,19-20,23-33,36-41H,12-13H2/b9-5+,10-4+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O16,pos_2_1proton1sodium,650.184685008,HFIRFUKEPOQTLQ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8551,841,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,NJZKNNCKRZJHCK-OGGREQCXSA-N,"InChI=1S/C30H34O16/c31-12-19-23(36)25(38)28(41)30(44-19)46-22(35)10-5-15-3-8-18(17(33)11-15)43-29-27(40)26(39)24(37)20(45-29)13-42-21(34)9-4-14-1-6-16(32)7-2-14/h1-11,19-20,23-33,36-41H,12-13H2/b9-4+,10-5+/t19-,20-,23-,24-,25+,26+,27-,28-,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H34O16,pos_2_1proton1sodium,650.1846850080001,NJZKNNCKRZJHCK,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 8552,840,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.33929983,ISDB,YQZPQSWEHQDLFL-ZACQAIPSSA-N,"InChI=1S/C18H37NO4/c1-2-3-4-9-12-15(20)13-10-7-5-6-8-11-14-16(21)17(19)18(22)23/h15-17,20-21H,2-14,19H2,1H3,(H,22,23)/t15-,16-,17+/m1/s1",CCCCCC[C@@H](O)CCCCCCCC[C@@H](O)[C@H](N)C(=O)O,C18H37NO4,,331.272258664,YQZPQSWEHQDLFL,Fatty acids,Fatty Acids and Conjugates,,Simplicillium minatense,411367.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Cordycipitaceae'],['Unknown'],['Simplicillium'],['Simplicillium minatense'],1,1,2.8571993112564087 8553,836,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.39960378,ISDB,KYSLCKVHRWLFQJ-UHFFFAOYSA-N,"InChI=1S/C24H47NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(26)25-22-19-20-23-25/h2-23H2,1H3",CCCCCCCCCCCCCCCCCCCC(=O)N1CCCC1,C24H47NO,,365.365765124,KYSLCKVHRWLFQJ,Fatty acids,Fatty amides,N-acyl amines,Piper amalago,383256.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper amalago'],0,1,2.0984151363372803 8554,835,275,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,0.0,MS1_match,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,pos_1_1sodium1acetonitrile,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,3,7.5 8555,834,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.5643755,ISDB,VQTFXJZYQVWHJA-UHFFFAOYSA-N,"InChI=1S/C13H14O3/c1-8-6-9-4-5-10(14)13(16-3)12(9)11(7-8)15-2/h4-7,14H,1-3H3",COc1cc(C)cc2ccc(O)c(OC)c12,C13H14O3,,218.094294308,VQTFXJZYQVWHJA,Polyketides,Naphthalenes,Naphthalenes and derivatives,Diospyros celebica,1256.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ebenaceae'],['Unknown'],['Diospyros'],['Diospyros celebica'],4,3,7.75750207901001 8556,833,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.42371783,ISDB,ADJGVADBICKKNW-DSLSCRDMSA-N,"InChI=1S/C41H62O11/c1-23(43)49-28-21-48-34(33(51-25(3)45)32(28)50-24(2)44)52-31-13-14-37(6)29(38(31,7)22-42)12-15-40(9)30(37)11-10-26-27-20-36(4,5)16-18-41(27,35(46)47)19-17-39(26,40)8/h10,27-34,42H,11-22H2,1-9H3,(H,46,47)/t27-,28-,29+,30+,31-,32-,33+,34-,37-,38-,39+,40+,41-/m0/s1",CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@]5(C(=O)O)CC[C@]34C)[C@]2(C)CO)OC[C@@H]1OC(C)=O,C41H62O11,,730.429212804,ADJGVADBICKKNW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Phyllanthus lawii,759796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Phyllanthus'],['Phyllanthus lawii'],4,3,7.194871306419373 8557,833,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.42371783,ISDB,ADJGVADBICKKNW-DSLSCRDMSA-N,"InChI=1S/C41H62O11/c1-23(43)49-28-21-48-34(33(51-25(3)45)32(28)50-24(2)44)52-31-13-14-37(6)29(38(31,7)22-42)12-15-40(9)30(37)11-10-26-27-20-36(4,5)16-18-41(27,35(46)47)19-17-39(26,40)8/h10,27-34,42H,11-22H2,1-9H3,(H,46,47)/t27-,28-,29+,30+,31-,32-,33+,34-,37-,38-,39+,40+,41-/m0/s1",CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@]5(C(=O)O)CC[C@]34C)[C@]2(C)CO)OC[C@@H]1OC(C)=O,C41H62O11,,730.429212804,ADJGVADBICKKNW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Phyllanthus polyphyllus,69050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Phyllanthaceae'],['Phyllantheae'],['Phyllanthus'],['Phyllanthus polyphyllus'],4,3,7.194871306419373 8558,827,607,,,,0.22895329,ISDB,,,,,,,XQQARSOXXGMYHZ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.915813148021698 8559,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-KZYULCMASA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22?,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,0,6.0 8560,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-KZYULCMASA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22?,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,0,6.0 8561,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-KZYULCMASA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22?,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,0,6.0 8562,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-UHFFFAOYSA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3",CC(=O)OC1CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C2C12CO2,C27H40O11,pos_1_1potassium,540.2570620999999,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8563,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-PXKJKYEHSA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22+,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 8564,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-KZYULCMASA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22?,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sitchensis,21459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sitchensis'],6,0,6.0 8565,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-KZYULCMASA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22?,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis congesta,830567.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis congesta'],6,0,6.0 8566,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-KZYULCMASA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22?,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Plectritis macrocera,945858.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Plectritis'],['Plectritis macrocera'],6,0,6.0 8567,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-UHFFFAOYSA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3",CC(=O)OC1CC2(O)C(COC(=O)C(OC(=O)CC(C)C)C(C)C)=COC(OC(=O)CC(C)C)C2C12CO2,C27H40O11,pos_1_1potassium,540.2570620999999,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8568,826,-1,,,,0.0,MS1_match,QPMVBTMUWDUUTJ-PXKJKYEHSA-N,"InChI=1S/C27H40O11/c1-14(2)8-20(29)37-22(16(5)6)24(31)33-11-18-12-34-25(38-21(30)9-15(3)4)23-26(18,32)10-19(36-17(7)28)27(23)13-35-27/h12,14-16,19,22-23,25,32H,8-11,13H2,1-7H3/t19-,22+,23-,25-,26-,27+/m0/s1",CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)[C@H](OC(=O)CC(C)C)C(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@]12CO2,C27H40O11,pos_1_1potassium,540.2570621,QPMVBTMUWDUUTJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 8569,826,-1,,,,0.0,MS1_match,UOZVACDGDZZCPO-IUWRHVCYSA-N,"InChI=1S/C27H40O11/c1-15(2)8-21(29)36-14-27(33)20(37-22(30)9-16(3)4)10-19-18(12-34-17(5)28)13-35-25(24(19)27)38-23(31)11-26(6,7)32/h10,13,15-16,20,24-25,32-33H,8-9,11-12,14H2,1-7H3/t20-,24+,25-,27+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)(C)O)[C@H]2C1=C[C@H](OC(=O)CC(C)C)[C@]2(O)COC(=O)CC(C)C,C27H40O11,pos_1_1potassium,540.2570620999999,UOZVACDGDZZCPO,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana sorbifolia,445623.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana sorbifolia'],6,0,6.0 8570,825,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.40271693,ISDB,SYELZBGXAIXKHU-UHFFFAOYSA-N,"InChI=1S/C14H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15(2,3)16/h4-14H2,1-3H3",CCCCCCCCCCCC[N+](C)(C)[O-],C14H31NO,,229.240564612,SYELZBGXAIXKHU,Fatty acids,Fatty acyls,Hydrocarbons,Euglena gracilis,1073327.0,['Eukaryota'],['Unknown'],['Euglenida'],['Euglenophyceae'],['Unknown'],['Euglenaceae'],['Unknown'],['Euglena'],['Euglena gracilis'],1,2,3.610867738723755 8571,823,-1,,,,0.6952524,ISDB,VZCCETWTMQHEPK-QNEBEIHSSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-",CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O,C18H30O2,,278.2245802,VZCCETWTMQHEPK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Anemone cylindrica,836008.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone cylindrica'],7,0,9.781009674072266 8572,823,-1,,,,0.6952524,ISDB,VZCCETWTMQHEPK-QNEBEIHSSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-",CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O,C18H30O2,,278.2245802,VZCCETWTMQHEPK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Anemone altaica,7049008.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone altaica'],7,0,9.781009674072266 8573,823,-1,,,,0.6952524,ISDB,VZCCETWTMQHEPK-QNEBEIHSSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-",CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O,C18H30O2,,278.2245802,VZCCETWTMQHEPK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Anemone nemorosa,233315.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone nemorosa'],7,0,9.781009674072266 8574,823,-1,,,,0.6952524,ISDB,VZCCETWTMQHEPK-QNEBEIHSSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-",CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O,C18H30O2,,278.2245802,VZCCETWTMQHEPK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Anemone ranunculoides,896063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone ranunculoides'],7,0,9.781009674072266 8575,823,-1,,,,0.6952524,ISDB,VZCCETWTMQHEPK-QNEBEIHSSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-",CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O,C18H30O2,,278.2245802,VZCCETWTMQHEPK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Anemone multifida,896056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone multifida'],7,0,9.781009674072266 8576,823,-1,,,,0.6952524,ISDB,VZCCETWTMQHEPK-QNEBEIHSSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-",CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O,C18H30O2,,278.2245802,VZCCETWTMQHEPK,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Anemone narcissiflora,896053.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Anemone'],['Anemone narcissiflora'],7,0,9.781009674072266 8577,822,23,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Furans,0.0,MS1_match,NOEGNKMFWQHSLB-UHFFFAOYSA-N,"InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2",O=Cc1ccc(CO)o1,C6H6O3,pos_2MHNH3,126.031694052,NOEGNKMFWQHSLB,Polyketides,Cyclic polyketides,Furans,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 8578,821,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.95331293,ISDB,XEXCLTHHXIWUHO-UHFFFAOYSA-N,"InChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)",O=C(O)CC(=O)OCC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C24H22O14,,534.1009553839998,XEXCLTHHXIWUHO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rubus adenotrichus,3906459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rubus'],['Rubus adenotrichos'],4,3,9.313251733779907 8579,821,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.95331293,ISDB,XEXCLTHHXIWUHO-UHFFFAOYSA-N,"InChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)",O=C(O)CC(=O)OCC1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O,C24H22O14,,534.1009553839998,XEXCLTHHXIWUHO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Rubus adenotrichos,3906459.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Unknown'],['Rubus'],['Rubus adenotrichos'],4,3,9.313251733779907 8580,821,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.95331293,ISDB,XEXCLTHHXIWUHO-CFXCJESKSA-N,"InChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)/t14-,18-,20-,21+,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@@H]1O,C24H22O14,,534.1009553839998,XEXCLTHHXIWUHO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,3,9.313251733779907 8581,821,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.95331293,ISDB,XEXCLTHHXIWUHO-CFXCJESKSA-N,"InChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)/t14-,18-,20-,21+,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@@H]1O,C24H22O14,,534.1009553839998,XEXCLTHHXIWUHO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Morus alba,658488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Moraceae'],['Unknown'],['Morus'],['Morus alba'],4,3,9.313251733779907 8582,821,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.95331293,ISDB,XEXCLTHHXIWUHO-CFXCJESKSA-N,"InChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)/t14-,18-,20-,21+,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@@H]1O,C24H22O14,,534.1009553839998,XEXCLTHHXIWUHO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Humulus lupulus,84020.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Cannabaceae'],['Unknown'],['Humulus'],['Humulus lupulus'],4,3,9.313251733779907 8583,821,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.95331293,ISDB,XEXCLTHHXIWUHO-NHODZQDWSA-N,"InChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)/t14-,18-,20?,21?,24+/m1/s1",O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)[C@@H]1O,C24H22O14,,534.1009553839998,XEXCLTHHXIWUHO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Vitex negundo var. cannabifolia,883037.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Vitex'],['Vitex negundo'],4,3,9.313251733779907 8584,816,-1,,,,0.0,MS1_match,OXZSUQJHKQOGOK-UHFFFAOYSA-N,"InChI=1S/C12H16O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5-8H,1-4H3",CC(=O)Oc1cc(C(C)C)ccc1C,C12H16O2,pos_2MNa,192.115029752,OXZSUQJHKQOGOK,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 8585,816,-1,,,,0.0,MS1_match,YWSIMWUTQXMOSD-FXAINCCUSA-N,"InChI=1S/C12H16O2/c1-8-4-3-5-9-10(13)6-7-11(14)12(8,9)2/h5-8,11,14H,3-4H2,1-2H3/t8-,11-,12+/m1/s1",C[C@@H]1CCC=C2C(=O)C=C[C@@H](O)[C@]21C,C12H16O2,pos_2MNa,192.115029752,YWSIMWUTQXMOSD,Terpenoids,Sesquiterpenoids,Nardosinane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 8586,816,-1,,,,0.0,MS1_match,YHPFWEDUGHFFTA-UHFFFAOYSA-N,"InChI=1S/C24H32O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,14,16,18-20,27H,4-5,7-13H2,1-2H3",CC12CCC(=O)CC1CCC1C2CCC2(C)C(c3ccc(=O)oc3)CCC12O,C24H32O4,pos_1_sodium,384.230059504,YHPFWEDUGHFFTA,Terpenoids,Steroids,Bufadienolides,Helleborus odorus,648059.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Helleboreae'],['Helleborus'],['Helleborus odorus'],6,0,6.0 8587,814,-1,,,,0.41752142,ISDB,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,9.670085668563843 8588,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,pos_2_1proton1sodium,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 8589,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,pos_2_1proton1sodium,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 8590,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,pos_2_1proton1sodium,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,3,7.5 8591,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,pos_2_1proton1sodium,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,3,7.5 8592,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,XUJMHSCMPCZWOV-XDHAJMPNSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h9,17,19-21,23-30,39-42H,8,10-16H2,1-7H3/t17-,19-,20+,21+,23-,24+,25+,26+,27-,28+,29-,30?,32+,33-,34+,35-,36?,37-/m1/s1",CC(=O)O[C@H]1CC23C[C@@]24CC[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(O)[C@@]1(C)O[C@@H]41,C37H54O11,pos_2_1proton1sodium,674.366612548,XUJMHSCMPCZWOV,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,3,7.5 8593,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,KRKLOCQWMFXIPR-UHFFFAOYSA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h17,19-29,39-41H,8-16H2,1-7H3",CC(=O)OC1CC23CC24CCC(OC2OCC(O)C(O)C2O)C(C)(C)C4CCC3C2(C)CC3OC4(CC(C)C3C12C)OC(=O)C1(C)OC41,C37H54O11,pos_2_1proton1sodium,674.366612548,KRKLOCQWMFXIPR,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,3,7.5 8594,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,KRKLOCQWMFXIPR-VHTKLTLISA-N,"InChI=1S/C37H54O11/c1-17-12-37(29-34(7,47-29)30(42)48-37)46-20-13-32(5)22-9-8-21-31(3,4)23(45-28-27(41)26(40)19(39)15-43-28)10-11-35(21)16-36(22,35)14-24(44-18(2)38)33(32,6)25(17)20/h17,19-29,39-41H,8-16H2,1-7H3/t17-,19-,20+,21+,22+,23+,24-,25+,26+,27-,28+,29+,32+,33-,34-,35-,36+,37-/m1/s1",CC(=O)O[C@@H]1C[C@@]23C[C@@]24CC[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC[C@H]3[C@]2(C)C[C@@H]3O[C@]4(C[C@@H](C)[C@@H]3[C@@]12C)OC(=O)[C@]1(C)O[C@H]41,C37H54O11,pos_2_1proton1sodium,674.366612548,KRKLOCQWMFXIPR,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea yunnanensis,512689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea yunnanensis'],6,3,7.5 8595,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,OCINLUMMCFTHHP-BWMQIKCRSA-N,"InChI=1S/C37H54O11/c1-17(13-19(39)30-33(5,6)48-30)25-27(42)29(44)34(7)22-10-9-21-32(3,4)23(47-31-28(43)26(41)20(40)15-45-31)11-12-36(21)16-37(22,36)14-24(35(25,34)8)46-18(2)38/h10,17,20-21,23-26,28-31,40-41,43-44H,9,11-16H2,1-8H3/t17-,20+,21+,23+,24-,25+,26+,28-,29+,30+,31+,34-,35-,36-,37+/m1/s1",CC(=O)O[C@@H]1C[C@@]23C[C@@]24CC[C@H](O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)[C@@H](O)C(=O)[C@H]([C@H](C)CC(=O)[C@@H]3OC3(C)C)[C@@]12C,C37H54O11,pos_2_1proton1sodium,674.3666125480001,OCINLUMMCFTHHP,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 8596,812,239,Terpenoids,Monoterpenoids,Cycloartane triterpenoids,0.0,MS1_match,OCINLUMMCFTHHP-BWMQIKCRSA-N,"InChI=1S/C37H54O11/c1-17(13-19(39)30-33(5,6)48-30)25-27(42)29(44)34(7)22-10-9-21-32(3,4)23(47-31-28(43)26(41)20(40)15-45-31)11-12-36(21)16-37(22,36)14-24(35(25,34)8)46-18(2)38/h10,17,20-21,23-26,28-31,40-41,43-44H,9,11-16H2,1-8H3/t17-,20+,21+,23+,24-,25+,26+,28-,29+,30+,31+,34-,35-,36-,37+/m1/s1",CC(=O)O[C@@H]1C[C@@]23C[C@@]24CC[C@H](O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]4CC=C3[C@]2(C)[C@@H](O)C(=O)[C@H]([C@H](C)CC(=O)[C@@H]3OC3(C)C)[C@@]12C,C37H54O11,pos_2_1proton1sodium,674.3666125480001,OCINLUMMCFTHHP,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,3,7.5 8597,810,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.6646829,ISDB,CAHQQYHQUHYOGU-XPXANVHNSA-N,"InChI=1S/C15H18O3/c1-10-5-4-6-11-9-13(18-14(11)17)15(2,3)8-7-12(10)16/h5,7-9,13H,4,6H2,1-3H3/b8-7+,10-5+/t13-/m1/s1",C/C1=C\CCC2=C[C@@H](OC2=O)C(C)(C)/C=C/C1=O,C15H18O3,,246.125594436,CAHQQYHQUHYOGU,Terpenoids,Sesquiterpenoids,Humulane sesquiterpenoids,Asteriscus daltonii,481186.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Asteriscus'],['Asteriscus daltonii'],4,2,7.658731698989868 8598,810,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.6646829,ISDB,CAHQQYHQUHYOGU-WGGPUXJNSA-N,"InChI=1S/C15H18O3/c1-10-5-4-6-11-9-13(18-14(11)17)15(2,3)8-7-12(10)16/h5,7-9,13H,4,6H2,1-3H3/b8-7-,10-5+/t13-/m0/s1",C/C1=C\CCC2=C[C@H](OC2=O)C(C)(C)/C=C\C1=O,C15H18O3,,246.125594436,CAHQQYHQUHYOGU,Terpenoids,Sesquiterpenoids,Humulane sesquiterpenoids,Asteriscus aquaticus,245282.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Asteriscus'],['Asteriscus aquaticus'],4,2,7.658731698989868 8599,810,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.6646829,ISDB,CAHQQYHQUHYOGU-WGGPUXJNSA-N,"InChI=1S/C15H18O3/c1-10-5-4-6-11-9-13(18-14(11)17)15(2,3)8-7-12(10)16/h5,7-9,13H,4,6H2,1-3H3/b8-7-,10-5+/t13-/m0/s1",C/C1=C\CCC2=C[C@H](OC2=O)C(C)(C)/C=C\C1=O,C15H18O3,,246.125594436,CAHQQYHQUHYOGU,Terpenoids,Sesquiterpenoids,Humulane sesquiterpenoids,Asteriscus intermedius,956601.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Asteriscus'],['Asteriscus intermedius'],4,2,7.658731698989868 8600,810,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.6646829,ISDB,CAHQQYHQUHYOGU-WGGPUXJNSA-N,"InChI=1S/C15H18O3/c1-10-5-4-6-11-9-13(18-14(11)17)15(2,3)8-7-12(10)16/h5,7-9,13H,4,6H2,1-3H3/b8-7-,10-5+/t13-/m0/s1",C/C1=C\CCC2=C[C@H](OC2=O)C(C)(C)/C=C\C1=O,C15H18O3,,246.125594436,CAHQQYHQUHYOGU,Terpenoids,Sesquiterpenoids,Humulane sesquiterpenoids,Asteriscus graveolens,481176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Asteriscus'],['Asteriscus graveolens'],4,2,7.658731698989868 8601,810,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.6646829,ISDB,CAHQQYHQUHYOGU-WGGPUXJNSA-N,"InChI=1S/C15H18O3/c1-10-5-4-6-11-9-13(18-14(11)17)15(2,3)8-7-12(10)16/h5,7-9,13H,4,6H2,1-3H3/b8-7-,10-5+/t13-/m0/s1",C/C1=C\CCC2=C[C@H](OC2=O)C(C)(C)/C=C\C1=O,C15H18O3,,246.125594436,CAHQQYHQUHYOGU,Terpenoids,Sesquiterpenoids,Humulane sesquiterpenoids,Asteriscus sericeus,931541.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Asteriscus'],['Asteriscus sericeus'],4,2,7.658731698989868 8602,810,464,Terpenoids,Sesquiterpenoids,Drimane sesquiterpenoids,0.6646829,ISDB,CAHQQYHQUHYOGU-DCHWWWNVSA-N,"InChI=1S/C15H18O3/c1-10-5-4-6-11-9-13(18-14(11)17)15(2,3)8-7-12(10)16/h5,7-9,13H,4,6H2,1-3H3/b8-7-,10-5-/t13-/m0/s1",C/C1=C/CCC2=C[C@H](OC2=O)C(C)(C)/C=C\C1=O,C15H18O3,,246.125594436,CAHQQYHQUHYOGU,Terpenoids,Sesquiterpenoids,Humulane sesquiterpenoids,Asteriscus vogelii,481180.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Asteriscus'],['Asteriscus vogelii'],4,2,7.658731698989868 8603,806,-1,,,,0.0,MS1_match,YEBHGSMKFNGICI-BUTDWOEESA-N,"InChI=1S/C38H62O11/c1-19-16-22(29(47-20(2)39)33(5,6)45-9)49-38(44)28(19)34(7)14-15-37-18-36(37)13-12-25(48-30-27(42)26(41)21(40)17-46-30)32(3,4)23(36)10-11-24(37)35(34,8)31(38)43/h19,21-31,40-44H,10-18H2,1-9H3/t19-,21-,22-,23+,24+,25+,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38-/m1/s1",COC(C)(C)[C@@H](OC(C)=O)[C@H]1C[C@@H](C)[C@H]2[C@@](O)(O1)[C@H](O)[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C,C38H62O11,pos_1_1proton1ammonium,694.429212804,YEBHGSMKFNGICI,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea yunnanensis,512689.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea yunnanensis'],6,0,6.0 8604,806,-1,,,,0.0,MS1_match,YEBHGSMKFNGICI-BUTDWOEESA-N,"InChI=1S/C38H62O11/c1-19-16-22(29(47-20(2)39)33(5,6)45-9)49-38(44)28(19)34(7)14-15-37-18-36(37)13-12-25(48-30-27(42)26(41)21(40)17-46-30)32(3,4)23(36)10-11-24(37)35(34,8)31(38)43/h19,21-31,40-44H,10-18H2,1-9H3/t19-,21-,22-,23+,24+,25+,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38-/m1/s1",COC(C)(C)[C@@H](OC(C)=O)[C@H]1C[C@@H](C)[C@H]2[C@@](O)(O1)[C@H](O)[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C,C38H62O11,pos_1_1proton1ammonium,694.429212804,YEBHGSMKFNGICI,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8605,806,-1,,,,0.0,MS1_match,YEBHGSMKFNGICI-BUTDWOEESA-N,"InChI=1S/C38H62O11/c1-19-16-22(29(47-20(2)39)33(5,6)45-9)49-38(44)28(19)34(7)14-15-37-18-36(37)13-12-25(48-30-27(42)26(41)21(40)17-46-30)32(3,4)23(36)10-11-24(37)35(34,8)31(38)43/h19,21-31,40-44H,10-18H2,1-9H3/t19-,21-,22-,23+,24+,25+,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38-/m1/s1",COC(C)(C)[C@@H](OC(C)=O)[C@H]1C[C@@H](C)[C@H]2[C@@](O)(O1)[C@H](O)[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C,C38H62O11,pos_1_1proton1ammonium,694.429212804,YEBHGSMKFNGICI,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8606,801,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.63882375,ISDB,AERBNCYCJBRYDG-KSZLIROESA-N,"InChI=1S/C18H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h16-18,20-22H,2-15,19H2,1H3/t16-,17+,18-/m0/s1",CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)CO,C18H39NO3,,317.292994108,AERBNCYCJBRYDG,Fatty acids,Sphingolipids,Sphingoid bases,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,2,7.555294990539551 8607,801,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.63882375,ISDB,AERBNCYCJBRYDG-KSZLIROESA-N,"InChI=1S/C18H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h16-18,20-22H,2-15,19H2,1H3/t16-,17+,18-/m0/s1",CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)CO,C18H39NO3,,317.292994108,AERBNCYCJBRYDG,Fatty acids,Sphingolipids,Sphingoid bases,Averrhoa bilimbi,829006.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Oxalidales'],['Oxalidaceae'],['Unknown'],['Averrhoa'],['Averrhoa bilimbi'],4,2,7.555294990539551 8608,801,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.63882375,ISDB,AERBNCYCJBRYDG-KSZLIROESA-N,"InChI=1S/C18H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h16-18,20-22H,2-15,19H2,1H3/t16-,17+,18-/m0/s1",CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)CO,C18H39NO3,,317.292994108,AERBNCYCJBRYDG,Fatty acids,Sphingolipids,Sphingoid bases,Asparagus officinalis,748359.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Asparagus'],['Asparagus officinalis'],4,2,7.555294990539551 8609,800,-1,,,,0.0,MS1_match,MCHOUIJOPUPQRU-UHFFFAOYSA-N,"InChI=1S/C13H18O3/c1-8-2-3-9-6-11(9)7-10(13(15)16)4-5-12(8)14/h7,9,11-12,14H,1-6H2,(H,15,16)",C=C1CCC2CC2C=C(C(=O)O)CCC1O,C13H18O3,pos_1_1proton1dmso,222.125594436,MCHOUIJOPUPQRU,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana dageletiana,7625130.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana dageletiana'],6,0,6.0 8610,800,-1,,,,0.0,MS1_match,MCHOUIJOPUPQRU-UHFFFAOYSA-N,"InChI=1S/C13H18O3/c1-8-2-3-9-6-11(9)7-10(13(15)16)4-5-12(8)14/h7,9,11-12,14H,1-6H2,(H,15,16)",C=C1CCC2CC2C=C(C(=O)O)CCC1O,C13H18O3,pos_1_1proton1dmso,222.125594436,MCHOUIJOPUPQRU,Terpenoids,Sesquiterpenoids,Bicyclogermacrane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8611,797,-1,,,,0.2269681,ISDB,,,,,,,CYGFHEVFZXDUGH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9078723788261414 8612,795,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.39055637,ISDB,AGHYYIRUYLLBAR-DOTOQJQBSA-N,"InChI=1S/C19H32O4/c1-15(20)9-7-5-3-2-4-6-8-10-17(21)11-16-12-18(22)14-19(23)13-16/h12-15,17,20-23H,2-11H2,1H3/t15-,17+/m0/s1",C[C@H](O)CCCCCCCCC[C@@H](O)Cc1cc(O)cc(O)c1,C19H32O4,,324.230059504,AGHYYIRUYLLBAR,Polyketides,,,Ononis pubescens,323322.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis pubescens'],4,0,5.5622254610061646 8613,792,-1,,,,0.37009606,ISDB,,,,,,,BZWZVFMHAZFRMA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.4803842306137085 8614,789,-1,,,,0.0,MS1_match,SESFRYSPDFLNCH-UHFFFAOYSA-N,"InChI=1S/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2",O=C(OCc1ccccc1)c1ccccc1,C14H12O2,pos_1_1proton1methanol,212.083729624,SESFRYSPDFLNCH,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8615,787,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,XNBHVNRFMHXLMZ-ODLFONTESA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19+,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_2MNa,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana microphylla,21453.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana microphylla'],6,1,6.5 8616,787,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,XNBHVNRFMHXLMZ-ODLFONTESA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19+,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_2MNa,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia saniculifolia,139326.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia saniculifolia'],6,1,6.5 8617,787,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,XNBHVNRFMHXLMZ-FJSYSMJUSA-N,"InChI=1S/C20H32O6/c1-11(2)6-17(22)24-9-14-10-25-20(26-18(23)7-12(3)4)19-13(5)16(21)8-15(14)19/h10-13,15-16,19-21H,6-9H2,1-5H3/t13-,15+,16-,19-,20-/m0/s1",CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H](C)[C@@H](O)C[C@H]12,C20H32O6,pos_2MNa,368.219888744,XNBHVNRFMHXLMZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 8618,785,122,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton1methanol,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 8619,784,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.35418126,ISDB,ABTMNXMGKVGBEE-UHFFFAOYSA-N,"InChI=1S/C30H38O/c1-14-18(10-17-11-19(14)28(17,4)5)26-22-12-20(29(22,6)7)15(2)24(26)25-16(3)21-13-23(27(25)31)30(21,8)9/h10,17,22-23,31H,11-13H2,1-9H3",CC1=C2CC(C=C1C1=C(C3=C(O)C4CC(=C3C)C4(C)C)C(C)=C3CC1C3(C)C)C2(C)C,C30H38O,,414.292265836,ABTMNXMGKVGBEE,Terpenoids,Sesquiterpenoids,Guaiane sesquiterpenoids,Origanum cordifolium,5801117.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Origanum'],['Origanum cordifolium'],0,1,1.9167250394821167 8620,783,-1,,,,0.72279507,ISDB,VFNUNYPYULIJSN-UHFFFAOYSA-N,"InChI=1S/C12H18O/c1-8(2)10-5-6-11(9(3)4)12(13)7-10/h5-9,13H,1-4H3",CC(C)c1ccc(C(C)C)c(O)c1,C12H18O,,178.135765196,VFNUNYPYULIJSN,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Thymus capitatus,27200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymbra'],['Thymbra capitata'],4,0,6.8911802768707275 8621,783,-1,,,,0.72279507,ISDB,VFNUNYPYULIJSN-UHFFFAOYSA-N,"InChI=1S/C12H18O/c1-8(2)10-5-6-11(9(3)4)12(13)7-10/h5-9,13H,1-4H3",CC(C)c1ccc(C(C)C)c(O)c1,C12H18O,,178.135765196,VFNUNYPYULIJSN,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Coridothymus capitatus,27200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymbra'],['Thymbra capitata'],4,0,6.8911802768707275 8622,783,-1,,,,0.72279507,ISDB,VFNUNYPYULIJSN-UHFFFAOYSA-N,"InChI=1S/C12H18O/c1-8(2)10-5-6-11(9(3)4)12(13)7-10/h5-9,13H,1-4H3",CC(C)c1ccc(C(C)C)c(O)c1,C12H18O,,178.135765196,VFNUNYPYULIJSN,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Thymus martinezii,27200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymbra'],['Thymbra capitata'],4,0,6.8911802768707275 8623,783,-1,,,,0.72279507,ISDB,VFNUNYPYULIJSN-UHFFFAOYSA-N,"InChI=1S/C12H18O/c1-8(2)10-5-6-11(9(3)4)12(13)7-10/h5-9,13H,1-4H3",CC(C)c1ccc(C(C)C)c(O)c1,C12H18O,,178.135765196,VFNUNYPYULIJSN,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Thymbra capitata,27200.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Thymbra'],['Thymbra capitata'],4,0,6.8911802768707275 8624,778,-1,,,,0.28206837,ISDB,WMAKRJDWSGWHCN-YELHDDRCSA-N,"InChI=1S/C39H60O4/c1-25(2)28(24-36(42)34(40)18-11-27-12-19-35(41)37(23-27)43-6)13-10-26(3)31-16-17-32-30-15-14-29-9-7-8-21-38(29,4)33(30)20-22-39(31,32)5/h11-12,18-19,23,25-26,28-33,36,41-42H,7-10,13-17,20-22,24H2,1-6H3/b18-11-/t26-,28+,29?,30+,31-,32+,33+,36?,38+,39-/m1/s1",COc1cc(/C=C\C(=O)C(O)C[C@H](CC[C@@H](C)[C@H]2CC[C@H]3[C@@H]4CCC5CCCC[C@]5(C)[C@H]4CC[C@]23C)C(C)C)ccc1O,C39H60O4,,592.4491604,WMAKRJDWSGWHCN,Terpenoids,Steroids,Cholestane steroids,Coix lacryma-jobi,83448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Andropogoneae'],['Coix'],['Coix lacryma-jobi'],4,0,5.1282734870910645 8625,776,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,IZJKNGKMGFLJCM-NICCLXCISA-N,"InChI=1S/C36H52O20/c1-7-15-17(9-23(45-3)46-4)19(31(43)47-5)12-50-33(15)56-36-29(42)27(40)30-22(53-36)14-49-24(54-30)10-18-16(8-2)34(51-13-20(18)32(44)48-6)55-35-28(41)26(39)25(38)21(11-37)52-35/h7-8,12-13,15-18,21-30,33-42H,1-2,9-11,14H2,3-6H3/t15-,16-,17+,18+,21-,22-,24-,25-,26+,27-,28-,29-,30-,33+,34+,35+,36+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1OC[C@H]2O[C@@H](O[C@@H]3OC=C(C(=O)OC)[C@@H](CC(OC)OC)[C@H]3C=C)[C@H](O)[C@@H](O)[C@@H]2O1,C36H52O20,pos_2_2proton,804.3051940640003,IZJKNGKMGFLJCM,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,2,8.0 8626,769,-1,,,,0.0,MS1_match,MUMCCPUVOAUBAN-UHFFFAOYSA-N,"InChI=1S/C17H9NO3/c19-16-11-4-2-1-3-10(11)14-13-9(5-6-18-15(13)16)7-12-17(14)21-8-20-12/h1-7H,8H2",O=C1c2ccccc2-c2c3c(cc4ccnc1c24)OCO3,C17H9NO3,pos_1_1proton1ethylamine,275.05824314800003,MUMCCPUVOAUBAN,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum javanicum,124737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum javanicum'],6,0,6.0 8627,769,-1,,,,0.0,MS1_match,MUMCCPUVOAUBAN-UHFFFAOYSA-N,"InChI=1S/C17H9NO3/c19-16-11-4-2-1-3-10(11)14-13-9(5-6-18-15(13)16)7-12-17(14)21-8-20-12/h1-7H,8H2",O=C1c2ccccc2-c2c3c(cc4ccnc1c24)OCO3,C17H9NO3,pos_1_1proton1ethylamine,275.05824314800003,MUMCCPUVOAUBAN,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum sessile,124737.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum javanicum'],6,0,6.0 8628,768,-1,,,,0.4579707,ISDB,NIIMHZMPAITCEZ-XEGQIGPUSA-N,"InChI=1S/C12H22O2S2/c1-4-6-7-9-12(16(13,14)15)10-11(3)8-5-2/h4-6,11-12H,2,7-10H2,1,3H3,(H,13,14,15)/b6-4-/t11-,12+/m0/s1",C=CC[C@H](C)C[C@@H](CC/C=C\C)S(=O)(O)=S,C12H22O2S2,,262.106121944,NIIMHZMPAITCEZ,Fatty acids,Fatty acyls,Fatty alcohols,Echinocardium cordatum,132767.0,['Eukaryota'],['Metazoa'],['Echinodermata'],['Echinoidea'],['Spatangoida'],['Loveniidae'],['Unknown'],['Echinocardium'],['Echinocardium cordatum'],1,0,2.8318828344345093 8629,765,-1,,,,0.0,MS1_match,KCAKQJIYVPOAJA-UHFFFAOYSA-N,"InChI=1S/C35H58O9/c1-29(2)21-7-8-22-31(5)15-19(37)27(32(6)11-9-24(44-32)30(3,4)41)35(31,18-36)14-13-34(22)17-33(21,34)12-10-23(29)43-28-26(40)25(39)20(38)16-42-28/h19-28,36-41H,7-18H2,1-6H3",CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CCC5C(C)(C)C(OC6OCC(O)C(O)C6O)CCC56CC46CCC23CO)O1,C35H58O9,pos_1_1proton1dmso,622.408083436,KCAKQJIYVPOAJA,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 8630,763,515,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,MWOOGOJBHIARFG-UHFFFAOYSA-N,"InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3",COc1cc(C=O)ccc1O,C8H8O3,pos_1_1proton1ammonium,152.047344116,MWOOGOJBHIARFG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 8631,762,-1,,,,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton2acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 8632,762,-1,,,,0.0,MS1_match,YMKQLZWZRFMJBN-UHFFFAOYSA-N,"InChI=1S/C21H26O11/c1-21(2,28)14-4-9-11(31-14)5-12-15(16(9)24)10(23)3-8(30-12)7-29-20-19(27)18(26)17(25)13(6-22)32-20/h3,5,13-14,17-20,22,24-28H,4,6-7H2,1-2H3",CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1,C21H26O11,pos_1_1proton2acetonitrile,454.147511652,YMKQLZWZRFMJBN,Polyketides,Chromanes,Chromones,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 8633,762,-1,,,,0.0,MS1_match,PBHOYFHVNTVOLB-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(8-30-21-19(29)18(28)17(27)15(7-23)32-21)2-3-11-12(24)5-14(26)16-13(25)4-10(6-22)31-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O11,pos_1_1proton2acetonitrile,454.147511652,PBHOYFHVNTVOLB,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 8634,762,-1,,,,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton2acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 8635,762,-1,,,,0.0,MS1_match,GWJOORMJFDUWLC-JEQBVLSKSA-N,"InChI=1S/C21H26O11/c1-9(6-22)2-3-11-14(31-21-19(29)18(28)17(27)15(8-24)32-21)5-13(26)16-12(25)4-10(7-23)30-20(11)16/h2,4-5,15,17-19,21-24,26-29H,3,6-8H2,1H3/b9-2+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(CO)oc12)CO,C21H26O11,pos_1_1proton2acetonitrile,454.147511652,GWJOORMJFDUWLC,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 8636,761,462,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,SWXBCXVNBGHVGG-VKGQNDASSA-N,"InChI=1S/C30H50O3/c1-19-20(31)8-9-21-26(19,4)11-10-22-27(21,5)13-14-29(7)23-18-25(2,3)12-16-30(23,24(32)33)17-15-28(22,29)6/h19-23,31H,8-18H2,1-7H3,(H,32,33)/t19-,20-,21+,22-,23-,26+,27-,28+,29-,30-/m0/s1",C[C@H]1[C@@H](O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3CC(C)(C)CC[C@]3(C(=O)O)CC[C@]12C,C30H50O3,pos_1_1proton1ammonium,458.37599546,SWXBCXVNBGHVGG,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,1,7.5 8637,761,462,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,FEHZXRNYETYZHE-NJURUNNASA-N,"InChI=1S/C30H50O3/c1-18(25(32)33)19-10-13-27(4)16-17-29(6)20(24(19)27)8-9-22-28(5)14-12-23(31)26(2,3)21(28)11-15-30(22,29)7/h18-24,31H,8-17H2,1-7H3,(H,32,33)/t18-,19-,20+,21-,22+,23+,24+,27+,28-,29+,30+/m0/s1",C[C@H](C(=O)O)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H50O3,pos_1_1proton1ammonium,458.37599546,FEHZXRNYETYZHE,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,1,7.5 8638,761,462,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,AFWRKTVVNVXFHY-KZJFYOBUSA-N,"InChI=1S/C30H50O3/c1-18(17-31)19-10-13-27(4)16-24(33)30(7)20(25(19)27)8-9-22-28(5)14-12-23(32)26(2,3)21(28)11-15-29(22,30)6/h18-22,24-25,31,33H,8-17H2,1-7H3/t18-,19-,20+,21-,22+,24-,25+,27+,28-,29+,30-/m0/s1",C[C@@H](CO)[C@@H]1CC[C@]2(C)C[C@H](O)[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12,C30H50O3,pos_1_1proton1ammonium,458.37599546,AFWRKTVVNVXFHY,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,1,7.5 8639,761,462,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,FCAUUNRKGRZMEJ-GRTLOISGSA-N,"InChI=1S/C30H50O3/c1-18(17-31)19-10-12-27(4)14-15-29(6)20(25(19)27)8-9-21-28(5)13-11-23(32)26(2,3)22(28)16-24(33)30(21,29)7/h18-22,24-25,31,33H,8-17H2,1-7H3/t18-,19-,20+,21+,22-,24-,25+,27+,28+,29+,30-/m0/s1",C[C@@H](CO)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5C[C@H](O)[C@]43C)[C@@H]12,C30H50O3,pos_1_1proton1ammonium,458.37599546,FCAUUNRKGRZMEJ,Terpenoids,Triterpenoids,Lupane triterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,1,7.5 8640,761,462,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,ZMSNKXDPESNSSS-CUKXIHTOSA-N,"InChI=1S/C30H50O3/c1-20-21(33)7-8-22-26(20,3)10-9-23-27(22,4)12-13-29(6)24-17-25(2,18-31)11-15-30(24,19-32)16-14-28(23,29)5/h20,22-24,31-32H,7-19H2,1-6H3/t20-,22+,23-,24-,25+,26+,27-,28+,29-,30+/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(CO)CC[C@]3(CO)CC[C@]12C,C30H50O3,pos_1_1proton1ammonium,458.37599546,ZMSNKXDPESNSSS,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus revolutus,6092646.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus revolutus'],7,1,7.5 8641,759,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.4877513,ISDB,,,,,,,OCHZTELGZBWSJD,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.951005220413208 8642,757,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DPBCFTHDJGXWRI-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(19)16(2,14(7)23-5-8(6)18)25-15-13(22)12(21)11(20)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1ammonium,362.157682412,DPBCFTHDJGXWRI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 8643,757,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBLVGADGVDUSHJ-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1ammonium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 8644,757,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBLVGADGVDUSHJ-RLIMOHGTSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7+,8-,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_1proton1ammonium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 8645,757,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RAKWYUWXLTYDQR-LTPIHACHSA-N,"InChI=1S/C16H26O9/c1-6-7-2-10(8(3-17)9(7)5-23-15(6)22)24-16-14(21)13(20)12(19)11(4-18)25-16/h6-14,16-21H,2-5H2,1H3/t6-,7-,8-,9+,10+,11-,12-,13+,14-,16-/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]21,C16H26O9,pos_1_1proton1ammonium,362.157682412,RAKWYUWXLTYDQR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 8646,757,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1ammonium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 8647,757,5,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_1proton1ammonium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 8648,755,-1,,,,0.0,MS1_match,AFIKQDOXLXLVDZ-NSOVKSMOSA-N,"InChI=1S/C37H40N2O7/c1-38-14-12-23-19-31(42-3)32-20-26(23)27(38)17-22-8-11-29(40)30(18-22)45-24-9-6-21(7-10-24)16-28-33-25(13-15-39(28)2)34(41)36(43-4)37(44-5)35(33)46-32/h6-11,18-20,27-28,40-41H,12-17H2,1-5H3/t27-,28-/m0/s1",COc1cc2c3cc1Oc1c(OC)c(OC)c(O)c4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3N(C)CC2)N(C)CC4,C37H40N2O7,pos_2_2proton2acetonitrile,624.28355162,AFIKQDOXLXLVDZ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum isopyroides,98291.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum isopyroides'],6,0,6.0 8649,755,-1,,,,0.0,MS1_match,AFIKQDOXLXLVDZ-NSOVKSMOSA-N,"InChI=1S/C37H40N2O7/c1-38-14-12-23-19-31(42-3)32-20-26(23)27(38)17-22-8-11-29(40)30(18-22)45-24-9-6-21(7-10-24)16-28-33-25(13-15-39(28)2)34(41)36(43-4)37(44-5)35(33)46-32/h6-11,18-20,27-28,40-41H,12-17H2,1-5H3/t27-,28-/m0/s1",COc1cc2c3cc1Oc1c(OC)c(OC)c(O)c4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3N(C)CC2)N(C)CC4,C37H40N2O7,pos_2_2proton2acetonitrile,624.28355162,AFIKQDOXLXLVDZ,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum fargesii,124386.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum fargesii'],6,0,6.0 8650,755,-1,,,,0.0,MS1_match,UUNKEDXSVBOYIU-NSOVKSMOSA-N,"InChI=1S/C37H40N2O7/c1-39-15-13-25-26-20-32(42-3)35(43-4)34(25)46-37-33-23(19-31(41-2)36(37)44-5)12-14-38-27(33)16-22-8-11-29(40)30(18-22)45-24-9-6-21(7-10-24)17-28(26)39/h6-11,18-20,27-28,38,40H,12-17H2,1-5H3/t27-,28-/m0/s1",COc1cc2c3c(c1OC)Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]2N(C)CC3)NCC4,C37H40N2O7,pos_2_2proton2acetonitrile,624.28355162,UUNKEDXSVBOYIU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,0,6.0 8651,755,-1,,,,0.0,MS1_match,QPCFSVGVRHGKFF-NSOVKSMOSA-N,"InChI=1S/C37H40N2O7/c1-38-15-13-25-26-20-32(43-4)36(44-5)35(25)46-37-33-23(19-31(42-3)34(37)41)12-14-39(2)28(33)17-22-8-11-29(40)30(18-22)45-24-9-6-21(7-10-24)16-27(26)38/h6-11,18-20,27-28,40-41H,12-17H2,1-5H3/t27-,28-/m0/s1",COc1cc2c3c(c1O)Oc1c4c(cc(OC)c1OC)[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3N(C)CC2)N(C)CC4,C37H40N2O7,pos_2_2proton2acetonitrile,624.2835516199999,QPCFSVGVRHGKFF,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,0,6.0 8652,755,-1,,,,0.0,MS1_match,MSEKZZNGEVAPPO-NSOVKSMOSA-N,"InChI=1S/C37H40N2O7/c1-39-15-13-25-26-20-32(43-4)36(44-5)35(25)46-37-33-23(19-31(42-3)34(37)40)12-14-38-27(33)16-22-8-11-29(41-2)30(18-22)45-24-9-6-21(7-10-24)17-28(26)39/h6-11,18-20,27-28,38,40H,12-17H2,1-5H3/t27-,28-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(O)c(OC)cc3c1[C@H](C2)NCC3,C37H40N2O7,pos_2_2proton2acetonitrile,624.2835516199999,MSEKZZNGEVAPPO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum flavum,250783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum flavum'],6,0,6.0 8653,755,-1,,,,0.0,MS1_match,MSEKZZNGEVAPPO-NSOVKSMOSA-N,"InChI=1S/C37H40N2O7/c1-39-15-13-25-26-20-32(43-4)36(44-5)35(25)46-37-33-23(19-31(42-3)34(37)40)12-14-38-27(33)16-22-8-11-29(41-2)30(18-22)45-24-9-6-21(7-10-24)17-28(26)39/h6-11,18-20,27-28,38,40H,12-17H2,1-5H3/t27-,28-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(O)c(OC)cc3c1[C@H](C2)NCC3,C37H40N2O7,pos_2_2proton2acetonitrile,624.2835516199999,MSEKZZNGEVAPPO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum alpinum,468431.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum alpinum'],6,0,6.0 8654,755,-1,,,,0.0,MS1_match,AJJJRLMIDHHVRN-VMPREFPWSA-N,"InChI=1S/C37H40N2O7/c1-38-14-12-24-26-20-33(37(44-5)34(24)40)46-36-25-13-15-39(2)28(27(25)19-32(43-4)35(36)41)16-21-6-9-23(10-7-21)45-31-18-22(17-29(26)38)8-11-30(31)42-3/h6-11,18-20,28-29,40-41H,12-17H2,1-5H3/t28-,29-/m0/s1",COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CCN1C)Oc1cc3c(c(O)c1OC)CCN(C)[C@H]3C2,C37H40N2O7,pos_2_2proton2acetonitrile,624.28355162,AJJJRLMIDHHVRN,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum cultratum,583170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum cultratum'],6,0,6.0 8655,755,-1,,,,0.0,MS1_match,OHWILNPYYFWACM-UHFFFAOYSA-N,"InChI=1S/C35H37NO7/c1-17-14-34-22-24(42-30(39)18-10-6-4-7-11-18)26-33(2)15-20-16-35(26,28(22)36(3)32(33)41-20)27(34)25(23(37)21(17)29(34)38)43-31(40)19-12-8-5-9-13-19/h4-13,20-29,32,37-38H,1,14-16H2,2-3H3",C=C1CC23C(O)C1C(O)C(OC(=O)c1ccccc1)C2C12CC4CC5(C)C(O4)N(C)C1C3C(OC(=O)c1ccccc1)C52,C35H37NO7,pos_2_2proton3acetonitrile,583.257002524,OHWILNPYYFWACM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 8656,751,-1,,,,0.0,MS1_match,JQSWONSGJKJQOF-XLWMKBOPSA-N,"InChI=1S/C36H56O10/c1-17-14-18-27(31(4,5)42)46-36(45-18)26(17)32(6)12-13-35-16-34(35)11-10-22(44-28-25(40)24(39)23(38)19(15-37)43-28)30(2,3)20(34)8-9-21(35)33(32,7)29(36)41/h9,17-20,22-29,37-42H,8,10-16H2,1-7H3/t17-,18-,19-,20-,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34-,35+,36+/m1/s1",C[C@@H]1C[C@H]2O[C@]3(O[C@@H]2C(C)(C)O)[C@H]1[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H]5CC=C4[C@]1(C)[C@H]3O,C36H56O10,pos_2_2proton,648.387347992,JQSWONSGJKJQOF,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8657,751,-1,,,,0.0,MS1_match,JQSWONSGJKJQOF-XLWMKBOPSA-N,"InChI=1S/C36H56O10/c1-17-14-18-27(31(4,5)42)46-36(45-18)26(17)32(6)12-13-35-16-34(35)11-10-22(44-28-25(40)24(39)23(38)19(15-37)43-28)30(2,3)20(34)8-9-21(35)33(32,7)29(36)41/h9,17-20,22-29,37-42H,8,10-16H2,1-7H3/t17-,18-,19-,20-,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34-,35+,36+/m1/s1",C[C@@H]1C[C@H]2O[C@]3(O[C@@H]2C(C)(C)O)[C@H]1[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H]5CC=C4[C@]1(C)[C@H]3O,C36H56O10,pos_2_2proton,648.387347992,JQSWONSGJKJQOF,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8658,750,-1,,,,0.0,MS1_match,AOEKSLVHJZEURZ-JLLNUDTQSA-N,"InChI=1S/C39H62O12/c1-20(41)48-29-30(35(7)13-11-26(51-35)34(5,6)46)39(19-40)16-15-38-18-37(38)14-12-25(50-32-28(45)27(44)22(43)17-47-32)33(3,4)23(37)9-10-24(38)36(39,8)31(29)49-21(2)42/h22-32,40,43-46H,9-19H2,1-8H3/t22-,23+,24+,25+,26-,27+,28-,29-,30-,31-,32+,35+,36-,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]2(CO)[C@H]1[C@]1(C)CC[C@H](C(C)(C)O)O1,C39H62O12,pos_1_1proton1ammonium,722.424127424,AOEKSLVHJZEURZ,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 8659,750,-1,,,,0.0,MS1_match,TVJIGVYTXZVMBU-JYXUTFFHSA-N,"InChI=1S/C39H62O12/c1-20(40)48-19-39-16-15-38-18-37(38)14-12-25(50-32-28(44)27(43)22(42)17-47-32)33(3,4)23(37)9-10-24(38)36(39,8)31(49-21(2)41)29(45)30(39)35(7)13-11-26(51-35)34(5,6)46/h22-32,42-46H,9-19H2,1-8H3/t22-,23+,24+,25+,26-,27+,28-,29-,30-,31+,32+,35+,36-,37-,38+,39+/m1/s1",CC(=O)OC[C@]12CC[C@@]34C[C@@]35CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@@H](OC(C)=O)[C@H](O)[C@@H]2[C@]1(C)CC[C@H](C(C)(C)O)O1,C39H62O12,pos_1_1proton1ammonium,722.4241274240001,TVJIGVYTXZVMBU,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Beesia calthifolia,877310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Beesia'],['Beesia calthifolia'],6,0,6.0 8660,749,-1,,,,0.0,MS1_match,JQSWONSGJKJQOF-XLWMKBOPSA-N,"InChI=1S/C36H56O10/c1-17-14-18-27(31(4,5)42)46-36(45-18)26(17)32(6)12-13-35-16-34(35)11-10-22(44-28-25(40)24(39)23(38)19(15-37)43-28)30(2,3)20(34)8-9-21(35)33(32,7)29(36)41/h9,17-20,22-29,37-42H,8,10-16H2,1-7H3/t17-,18-,19-,20-,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34-,35+,36+/m1/s1",C[C@@H]1C[C@H]2O[C@]3(O[C@@H]2C(C)(C)O)[C@H]1[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H]5CC=C4[C@]1(C)[C@H]3O,C36H56O10,pos_2_2sodium,648.387347992,JQSWONSGJKJQOF,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8661,749,-1,,,,0.0,MS1_match,JQSWONSGJKJQOF-XLWMKBOPSA-N,"InChI=1S/C36H56O10/c1-17-14-18-27(31(4,5)42)46-36(45-18)26(17)32(6)12-13-35-16-34(35)11-10-22(44-28-25(40)24(39)23(38)19(15-37)43-28)30(2,3)20(34)8-9-21(35)33(32,7)29(36)41/h9,17-20,22-29,37-42H,8,10-16H2,1-7H3/t17-,18-,19-,20-,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34-,35+,36+/m1/s1",C[C@@H]1C[C@H]2O[C@]3(O[C@@H]2C(C)(C)O)[C@H]1[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H]5CC=C4[C@]1(C)[C@H]3O,C36H56O10,pos_2_2sodium,648.387347992,JQSWONSGJKJQOF,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8662,749,-1,,,,0.0,MS1_match,MGTJNQWIXFSPLC-DMCHUPBKSA-N,"InChI=1S/C35H49NO12/c1-8-36-15-32(16-42-3)21(38)13-22(44-5)34-20-14-33(41)29(47-31(40)18-9-11-19(43-4)12-10-18)23(20)35(48-17(2)37,28(39)30(33)46-7)24(27(34)36)25(45-6)26(32)34/h9-12,20-30,38-39,41H,8,13-16H2,1-7H3/t20-,21-,22+,23-,24+,25+,26-,27-,28+,29-,30+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccc(OC)cc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C35H49NO12,pos_2_2proton1ammonium,675.3254760079999,MGTJNQWIXFSPLC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 8663,749,-1,,,,0.0,MS1_match,MGTJNQWIXFSPLC-DMCHUPBKSA-N,"InChI=1S/C35H49NO12/c1-8-36-15-32(16-42-3)21(38)13-22(44-5)34-20-14-33(41)29(47-31(40)18-9-11-19(43-4)12-10-18)23(20)35(48-17(2)37,28(39)30(33)46-7)24(27(34)36)25(45-6)26(32)34/h9-12,20-30,38-39,41H,8,13-16H2,1-7H3/t20-,21-,22+,23-,24+,25+,26-,27-,28+,29-,30+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccc(OC)cc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C35H49NO12,pos_2_2proton1ammonium,675.3254760079999,MGTJNQWIXFSPLC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 8664,749,-1,,,,0.0,MS1_match,MGTJNQWIXFSPLC-DMCHUPBKSA-N,"InChI=1S/C35H49NO12/c1-8-36-15-32(16-42-3)21(38)13-22(44-5)34-20-14-33(41)29(47-31(40)18-9-11-19(43-4)12-10-18)23(20)35(48-17(2)37,28(39)30(33)46-7)24(27(34)36)25(45-6)26(32)34/h9-12,20-30,38-39,41H,8,13-16H2,1-7H3/t20-,21-,22+,23-,24+,25+,26-,27-,28+,29-,30+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccc(OC)cc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C35H49NO12,pos_2_2proton1ammonium,675.3254760079999,MGTJNQWIXFSPLC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,0,6.0 8665,749,-1,,,,0.0,MS1_match,MGTJNQWIXFSPLC-DMCHUPBKSA-N,"InChI=1S/C35H49NO12/c1-8-36-15-32(16-42-3)21(38)13-22(44-5)34-20-14-33(41)29(47-31(40)18-9-11-19(43-4)12-10-18)23(20)35(48-17(2)37,28(39)30(33)46-7)24(27(34)36)25(45-6)26(32)34/h9-12,20-30,38-39,41H,8,13-16H2,1-7H3/t20-,21-,22+,23-,24+,25+,26-,27-,28+,29-,30+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccc(OC)cc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C35H49NO12,pos_2_2proton1ammonium,675.3254760079999,MGTJNQWIXFSPLC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sachalinense,1064657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sachalinense'],6,0,6.0 8666,749,-1,,,,0.0,MS1_match,MGTJNQWIXFSPLC-DMCHUPBKSA-N,"InChI=1S/C35H49NO12/c1-8-36-15-32(16-42-3)21(38)13-22(44-5)34-20-14-33(41)29(47-31(40)18-9-11-19(43-4)12-10-18)23(20)35(48-17(2)37,28(39)30(33)46-7)24(27(34)36)25(45-6)26(32)34/h9-12,20-30,38-39,41H,8,13-16H2,1-7H3/t20-,21-,22+,23-,24+,25+,26-,27-,28+,29-,30+,32+,33-,34+,35-/m1/s1",CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34[C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccc(OC)cc7)[C@@H]5[C@@](OC(C)=O)([C@@H]([C@H](OC)[C@H]23)[C@@H]14)[C@@H](O)[C@@H]6OC,C35H49NO12,pos_2_2proton1ammonium,675.3254760079999,MGTJNQWIXFSPLC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 8667,749,-1,,,,0.0,MS1_match,NGQFJGJYHKQJFM-OOHMBUEHSA-N,"InChI=1S/C35H49NO12/c1-8-36-15-32(16-42-3)26-25(45-6)23-27(36)35(26,30(46-7)24(38)28(32)39)20-13-33(41)21(44-5)14-34(23,48-17(2)37)22(20)29(33)47-31(40)18-9-11-19(43-4)12-10-18/h9-12,20-30,38-39,41H,8,13-16H2,1-7H3/t20-,21+,22-,23+,24-,25+,26-,27-,28-,29-,30+,32-,33+,34-,35+/m1/s1",CCN1C[C@]2(COC)[C@H](O)[C@@H](O)[C@H](OC)[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](OC(C)=O)([C@H]5[C@H]6OC(=O)c5ccc(OC)cc5)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C35H49NO12,pos_2_2proton1ammonium,675.3254760079999,NGQFJGJYHKQJFM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,0,6.0 8668,748,-1,,,,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_sodium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8669,748,-1,,,,0.0,MS1_match,SXGSYHDLSPXCMU-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-14(4-5-16(18)29)24-15(10-27)26(33,12-36-24)9-13-3-6-17(19(7-13)35-2)37-25-23(32)22(31)21(30)20(11-28)38-25/h3-8,15,20-25,27-33H,9-12H2,1-2H3",COc1cc(C2OCC(O)(Cc3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_sodium,538.205026528,SXGSYHDLSPXCMU,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8670,748,-1,,,,0.0,MS1_match,QNDLGCSMZUBKMI-ASTYLPHCSA-N,"InChI=1S/C26H34O12/c1-14(27)32-11-17-12-33-23(36-21(31)10-25(6,7)38-16(3)29)22-18(17)8-19(26(22)13-34-26)35-20(30)9-24(4,5)37-15(2)28/h8,12,19,22-23H,9-11,13H2,1-7H3/t19-,22+,23-,26+/m0/s1",CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)(C)OC(C)=O)[C@H]2C1=C[C@H](OC(=O)CC(C)(C)OC(C)=O)[C@]21CO1,C26H34O12,pos_1_sodium,538.205026528,QNDLGCSMZUBKMI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana pulvinata,7625148.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana pulvinata'],6,0,6.0 8671,748,-1,,,,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_sodium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8672,748,-1,,,,0.0,MS1_match,WDTFNYPORMFVPG-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-35-17-5-12(3-4-16(17)30)21-14-7-19(37-25-24(33)23(32)22(31)20(10-28)38-25)18(36-2)6-13(14)8-26(34,11-29)15(21)9-27/h3-7,15,20-25,27-34H,8-11H2,1-2H3",COc1cc(C2c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3CC(O)(CO)C2CO)ccc1O,C26H34O12,pos_1_sodium,538.205026528,WDTFNYPORMFVPG,Shikimates and Phenylpropanoids,Lignans,Arylnaphthalene and aryltetralin lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8673,748,-1,,,,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_sodium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8674,748,-1,,,,0.0,MS1_match,LDDSFQCOUIDFIZ-UHFFFAOYSA-N,"InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3",COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O,C26H34O12,pos_1_sodium,538.205026528,LDDSFQCOUIDFIZ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8675,747,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.432716,ISDB,UUAGMUWFWZGYBW-DKXFVNHDSA-N,"InChI=1S/C36H66O2Si2/c1-31(2)20-22-36(25-37-39(8,9)10)23-21-34(6)26(27(36)24-31)14-15-29-33(5)18-17-30(38-40(11,12)13)32(3,4)28(33)16-19-35(29,34)7/h14,27-30H,15-25H2,1-13H3/t27-,28-,29+,30-,33-,34+,35+,36+/m0/s1",CC1(C)CC[C@]2(CO[Si](C)(C)C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[Si](C)(C)C)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H66O2Si2,,586.460134412,UUAGMUWFWZGYBW,Terpenoids,Triterpenoids,Oleanane triterpenoids,Chenopodium quinoa,117198.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Chenopodiaceae'],['Atripliceae'],['Chenopodium'],['Chenopodium quinoa'],4,0,5.73086404800415 8676,741,700,Amino acids and Peptides,Small peptides,Dipeptides,0.5830007,ISDB,BQBCIBCLXBKYHW-CSMHCCOUSA-N,"InChI=1S/C10H20N2O4/c1-5(2)4-7(10(15)16)12-9(14)8(11)6(3)13/h5-8,13H,4,11H2,1-3H3,(H,12,14)(H,15,16)/t6-,7+,8+/m1/s1",CC(C)C[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,C10H20N2O4,,232.14230712,BQBCIBCLXBKYHW,Amino acids and Peptides,Small peptides,Dipeptides,Valsa sordida,382306.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Diaporthales'],['Valsaceae'],['Unknown'],['Valsa'],['Valsa sordida'],1,3,4.832002878189087 8677,738,941,Terpenoids,Steroids,Cholestane steroids,0.0,MS1_match,UPJVQRZPXLZUET-KGHQQZOUSA-N,"InChI=1S/C28H46O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26,30)15-16-28(23,24)31/h7-8,15-16,18-24,29-31H,9-14,17H2,1-6H3/b8-7+/t19-,20+,21-,22+,23+,24+,25+,26+,27+,28-/m0/s1",CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@]3(O)C=C[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C28H46O3,pos_1_1proton1methanol,430.344695332,UPJVQRZPXLZUET,Terpenoids,Steroids,Cholestane steroids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,7.5 8678,737,544,Terpenoids,Sesquiterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,pos_1_1proton1methanol,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,2,7.0 8679,736,-1,,,,0.6562079,ISDB,GLFSTVQYXPOBGJ-UHFFFAOYSA-N,"InChI=1S/C19H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(21)22/h2-17H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCC(=O)C(=O)O,C19H36O3,,312.266445012,GLFSTVQYXPOBGJ,Fatty acids,Fatty Acids and Conjugates,Oxo fatty acids,Lepidium meyenii,681784.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Lepidieae'],['Lepidium'],['Lepidium meyenii'],4,0,6.624831676483154 8680,735,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.30861542,ISDB,UODJOGKPOAZZHT-HIQAQFGRSA-N,"InChI=1S/C39H56O12/c1-20(40)49-26-19-48-33(30(29(26)44)50-21(2)41)51-25-18-38(9)27-12-11-22-23(17-24(42)32(45)35(22,5)6)36(27,7)15-16-37(38,8)31(25)39(10,47)28(43)13-14-34(3,4)46/h11,13-14,17,23,25-27,29-31,33,42,44,46-47H,12,15-16,18-19H2,1-10H3/b14-13+/t23-,25-,26-,27-,29+,30-,31+,33+,36+,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@@H]2C[C@@]3(C)[C@@H]4CC=C5[C@@H](C=C(O)C(=O)C5(C)C)[C@]4(C)CC[C@]3(C)[C@H]2[C@@](C)(O)C(=O)/C=C/C(C)(C)O)OC[C@@H](OC(C)=O)[C@@H]1O,C39H56O12,,716.377177232,UODJOGKPOAZZHT,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Tetradium glabrifolium,164592.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Tetradium'],['Tetradium glabrifolium'],4,2,6.234461665153503 8681,735,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.30861542,ISDB,UODJOGKPOAZZHT-OCCINUARSA-N,"InChI=1S/C39H56O12/c1-20(40)49-26-19-48-33(30(29(26)44)50-21(2)41)51-25-18-38(9)27-12-11-22-23(17-24(42)32(45)35(22,5)6)36(27,7)15-16-37(38,8)31(25)39(10,47)28(43)13-14-34(3,4)46/h11,13-14,17,23,25-27,29-31,33,42,44,46-47H,12,15-16,18-19H2,1-10H3/b14-13+/t23-,25-,26+,27-,29+,30-,31+,33+,36+,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@@H]2C[C@@]3(C)[C@@H]4CC=C5[C@@H](C=C(O)C(=O)C5(C)C)[C@]4(C)CC[C@]3(C)[C@H]2[C@@](C)(O)C(=O)/C=C/C(C)(C)O)OC[C@H](OC(C)=O)[C@@H]1O,C39H56O12,,716.377177232,UODJOGKPOAZZHT,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Desfontainia spinosa,107904.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Bruniales'],['Columelliaceae'],['Unknown'],['Desfontainia'],['Desfontainia spinosa'],4,2,6.234461665153503 8682,735,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.30861542,ISDB,UODJOGKPOAZZHT-OCCINUARSA-N,"InChI=1S/C39H56O12/c1-20(40)49-26-19-48-33(30(29(26)44)50-21(2)41)51-25-18-38(9)27-12-11-22-23(17-24(42)32(45)35(22,5)6)36(27,7)15-16-37(38,8)31(25)39(10,47)28(43)13-14-34(3,4)46/h11,13-14,17,23,25-27,29-31,33,42,44,46-47H,12,15-16,18-19H2,1-10H3/b14-13+/t23-,25-,26+,27-,29+,30-,31+,33+,36+,37-,38+,39+/m1/s1",CC(=O)O[C@H]1[C@H](O[C@@H]2C[C@@]3(C)[C@@H]4CC=C5[C@@H](C=C(O)C(=O)C5(C)C)[C@]4(C)CC[C@]3(C)[C@H]2[C@@](C)(O)C(=O)/C=C/C(C)(C)O)OC[C@H](OC(C)=O)[C@@H]1O,C39H56O12,,716.377177232,UODJOGKPOAZZHT,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Desfontainia fulgens,107904.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Bruniales'],['Columelliaceae'],['Unknown'],['Desfontainia'],['Desfontainia spinosa'],4,2,6.234461665153503 8683,729,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],9,0,9.0 8684,729,-1,,,,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],9,0,9.0 8685,728,-1,,,,0.6577702,ISDB,LFBIHCZSRPAPHS-UHFFFAOYSA-N,"InChI=1S/C19H12O7/c1-23-16-9-15-11(6-13(16)20)7-17(19(22)26-15)24-12-4-2-10-3-5-18(21)25-14(10)8-12/h2-9,20H,1H3",COc1cc2oc(=O)c(Oc3ccc4ccc(=O)oc4c3)cc2cc1O,C19H12O7,,352.058302724,LFBIHCZSRPAPHS,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Eucalyptus viminalis,566581.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Myrtaceae'],['Eucalypteae'],['Eucalyptus'],['Eucalyptus viminalis'],4,0,6.631080865859985 8686,728,-1,,,,0.6577702,ISDB,LFBIHCZSRPAPHS-UHFFFAOYSA-N,"InChI=1S/C19H12O7/c1-23-16-9-15-11(6-13(16)20)7-17(19(22)26-15)24-12-4-2-10-3-5-18(21)25-14(10)8-12/h2-9,20H,1H3",COc1cc2oc(=O)c(Oc3ccc4ccc(=O)oc4c3)cc2cc1O,C19H12O7,,352.058302724,LFBIHCZSRPAPHS,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Edgeworthia chrysantha,268293.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Edgeworthia'],['Edgeworthia chrysantha'],4,0,6.631080865859985 8687,728,-1,,,,0.6577702,ISDB,LFBIHCZSRPAPHS-UHFFFAOYSA-N,"InChI=1S/C19H12O7/c1-23-16-9-15-11(6-13(16)20)7-17(19(22)26-15)24-12-4-2-10-3-5-18(21)25-14(10)8-12/h2-9,20H,1H3",COc1cc2oc(=O)c(Oc3ccc4ccc(=O)oc4c3)cc2cc1O,C19H12O7,,352.058302724,LFBIHCZSRPAPHS,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ruta montana,397678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Ruta'],['Ruta montana'],4,0,6.631080865859985 8688,726,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,CYIFGHJXUWZGSW-GRXCUHEDSA-N,"InChI=1S/C36H51NO11/c1-9-37-17-33(18-41-3)13-12-24(44-6)36-21-15-34(40)25(45-7)16-35(48-19(2)38,27(30(36)37)28(46-8)29(33)36)26(21)31(34)47-32(39)20-10-11-22(42-4)23(14-20)43-5/h10-11,14,21,24-31,40H,9,12-13,15-18H2,1-8H3/t21-,24+,25+,26-,27+,28+,29-,30?,31-,33+,34+,35-,36+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(OC(C)=O)C[C@H](OC)[C@@]2(O)C[C@@H]4[C@@H]1[C@H]2OC(=O)c1ccc(OC)c(OC)c1,C36H51NO11,pos_1_minus1proton2potassium,673.3462114519999,CYIFGHJXUWZGSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,3,7.5 8689,726,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,CYIFGHJXUWZGSW-GRXCUHEDSA-N,"InChI=1S/C36H51NO11/c1-9-37-17-33(18-41-3)13-12-24(44-6)36-21-15-34(40)25(45-7)16-35(48-19(2)38,27(30(36)37)28(46-8)29(33)36)26(21)31(34)47-32(39)20-10-11-22(42-4)23(14-20)43-5/h10-11,14,21,24-31,40H,9,12-13,15-18H2,1-8H3/t21-,24+,25+,26-,27+,28+,29-,30?,31-,33+,34+,35-,36+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(OC(C)=O)C[C@H](OC)[C@@]2(O)C[C@@H]4[C@@H]1[C@H]2OC(=O)c1ccc(OC)c(OC)c1,C36H51NO11,pos_1_minus1proton2potassium,673.3462114519999,CYIFGHJXUWZGSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 8690,726,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,CYIFGHJXUWZGSW-OENHWFPTSA-N,"InChI=1S/C36H51NO11/c1-9-37-17-33(18-41-3)13-12-24(44-6)36-21-15-34(40)25(45-7)16-35(48-19(2)38,27(30(36)37)28(46-8)29(33)36)26(21)31(34)47-32(39)20-10-11-22(42-4)23(14-20)43-5/h10-11,14,21,24-31,40H,9,12-13,15-18H2,1-8H3/t21-,24-,25-,26-,27-,28-,29+,30+,31+,33-,34+,35-,36-/m0/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@@H]13)[C@]1(OC(C)=O)C[C@H](OC)[C@]2(O)C[C@H]4[C@H]1[C@H]2OC(=O)c1ccc(OC)c(OC)c1,C36H51NO11,pos_1_minus1proton2potassium,673.346211452,CYIFGHJXUWZGSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ferox,1014250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ferox'],6,3,7.5 8691,726,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,CYIFGHJXUWZGSW-GRXCUHEDSA-N,"InChI=1S/C36H51NO11/c1-9-37-17-33(18-41-3)13-12-24(44-6)36-21-15-34(40)25(45-7)16-35(48-19(2)38,27(30(36)37)28(46-8)29(33)36)26(21)31(34)47-32(39)20-10-11-22(42-4)23(14-20)43-5/h10-11,14,21,24-31,40H,9,12-13,15-18H2,1-8H3/t21-,24+,25+,26-,27+,28+,29-,30?,31-,33+,34+,35-,36+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(OC(C)=O)C[C@H](OC)[C@@]2(O)C[C@@H]4[C@@H]1[C@H]2OC(=O)c1ccc(OC)c(OC)c1,C36H51NO11,pos_1_minus1proton2potassium,673.3462114519999,CYIFGHJXUWZGSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,3,7.5 8692,726,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,CYIFGHJXUWZGSW-GRXCUHEDSA-N,"InChI=1S/C36H51NO11/c1-9-37-17-33(18-41-3)13-12-24(44-6)36-21-15-34(40)25(45-7)16-35(48-19(2)38,27(30(36)37)28(46-8)29(33)36)26(21)31(34)47-32(39)20-10-11-22(42-4)23(14-20)43-5/h10-11,14,21,24-31,40H,9,12-13,15-18H2,1-8H3/t21-,24+,25+,26-,27+,28+,29-,30?,31-,33+,34+,35-,36+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(OC(C)=O)C[C@H](OC)[C@@]2(O)C[C@@H]4[C@@H]1[C@H]2OC(=O)c1ccc(OC)c(OC)c1,C36H51NO11,pos_1_minus1proton2potassium,673.3462114519999,CYIFGHJXUWZGSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 8693,726,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,CYIFGHJXUWZGSW-OENHWFPTSA-N,"InChI=1S/C36H51NO11/c1-9-37-17-33(18-41-3)13-12-24(44-6)36-21-15-34(40)25(45-7)16-35(48-19(2)38,27(30(36)37)28(46-8)29(33)36)26(21)31(34)47-32(39)20-10-11-22(42-4)23(14-20)43-5/h10-11,14,21,24-31,40H,9,12-13,15-18H2,1-8H3/t21-,24-,25-,26-,27-,28-,29+,30+,31+,33-,34+,35-,36-/m0/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@@H]13)[C@]1(OC(C)=O)C[C@H](OC)[C@]2(O)C[C@H]4[C@H]1[C@H]2OC(=O)c1ccc(OC)c(OC)c1,C36H51NO11,pos_1_minus1proton2potassium,673.346211452,CYIFGHJXUWZGSW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ferox,1014250.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ferox'],6,3,7.5 8694,726,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DXAQZKJLRXMIFW-NNSXUSQFSA-N,"InChI=1S/C36H51NO11/c1-8-37-17-33(18-42-4)22(47-19(3)38)15-23(43-5)35-21-16-34(41)30(48-32(40)20-13-11-10-12-14-20)24(21)36(46-9-2,29(39)31(34)45-7)25(28(35)37)26(44-6)27(33)35/h10-14,21-31,39,41H,8-9,15-18H2,1-7H3/t21-,22-,23+,24-,25+,26+,27-,28-,29+,30-,31+,33+,34-,35+,36-/m1/s1",CCO[C@]12[C@H]3[C@@H](OC(=O)c4ccccc4)[C@](O)(C[C@H]3[C@@]34[C@@H](OC)C[C@@H](OC(C)=O)[C@@]5(COC)CN(CC)[C@@H]3[C@@H]1[C@H](OC)[C@H]54)[C@@H](OC)[C@@H]2O,C36H51NO11,pos_1_minus1proton2potassium,673.346211452,DXAQZKJLRXMIFW,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum polyschistum,6131475.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum polyschistum'],6,3,7.5 8695,724,-1,,,,0.6253756,ISDB,QBFNGLBSVFKILI-UHFFFAOYSA-N,"InChI=1S/C9H8O/c1-2-8-3-5-9(7-10)6-4-8/h2-7H,1H2",C=Cc1ccc(C=O)cc1,C9H8O,,132.057514876,QBFNGLBSVFKILI,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,Cinnamomum sieboldii,130590.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Cinnamomum'],['Cinnamomum sieboldii'],4,0,6.501502513885498 8696,721,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.5360467,ISDB,HUSISCNTLUEZCN-JWRMENJJSA-N,"InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3/b4-3+,7-6+,10-9-/t21-,22+,24-,25-,26+,27+/m0/s1",CC/C=C/C/C=C/C/C=C\CCCCCCCC(=O)OC[C@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C27H46O9,,514.3141830519999,HUSISCNTLUEZCN,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Vitis heyneana,568884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis heyneana'],4,2,7.144186735153198 8697,721,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.5360467,ISDB,HUSISCNTLUEZCN-DTYSIQRPSA-N,"InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3/b4-3-,7-6-,10-9-/t21-,22-,24+,25+,26-,27-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C27H46O9,,514.314183052,HUSISCNTLUEZCN,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Isatis tinctoria,631500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Isatideae'],['Isatis'],['Isatis tinctoria'],4,2,7.144186735153198 8698,721,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.5360467,ISDB,HUSISCNTLUEZCN-DTYSIQRPSA-N,"InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3/b4-3-,7-6-,10-9-/t21-,22-,24+,25+,26-,27-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C27H46O9,,514.314183052,HUSISCNTLUEZCN,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,7.144186735153198 8699,721,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.5360467,ISDB,HUSISCNTLUEZCN-DTYSIQRPSA-N,"InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3/b4-3-,7-6-,10-9-/t21-,22-,24+,25+,26-,27-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C27H46O9,,514.314183052,HUSISCNTLUEZCN,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Clinacanthus nutans,129764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Acanthaceae'],['Justicieae'],['Clinacanthus'],['Clinacanthus nutans'],4,2,7.144186735153198 8700,721,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.5360467,ISDB,HUSISCNTLUEZCN-DTYSIQRPSA-N,"InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3/b4-3-,7-6-,10-9-/t21-,22-,24+,25+,26-,27-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C27H46O9,,514.314183052,HUSISCNTLUEZCN,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Guapira graciliflora,6038299.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Nyctaginaceae'],['Unknown'],['Guapira'],['Guapira graciliflora'],4,2,7.144186735153198 8701,721,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.5360467,ISDB,HUSISCNTLUEZCN-DTYSIQRPSA-N,"InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3/b4-3-,7-6-,10-9-/t21-,22-,24+,25+,26-,27-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C27H46O9,,514.314183052,HUSISCNTLUEZCN,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Sonchus arvensis,761934.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus arvensis'],4,2,7.144186735153198 8702,721,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.5360467,ISDB,HUSISCNTLUEZCN-DTYSIQRPSA-N,"InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3/b4-3-,7-6-,10-9-/t21-,22-,24+,25+,26-,27-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C27H46O9,,514.314183052,HUSISCNTLUEZCN,Fatty acids,Glycerolipids,Glycosylmonoacylglycerols,Sonchus mauritanicus,572923.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cichorieae'],['Sonchus'],['Sonchus mauritanicus'],4,2,7.144186735153198 8703,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 8704,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudolaeve,6131483.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum pseudolaeve'],6,0,6.0 8705,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium cashmerianum,884026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cashmerianum'],6,0,6.0 8706,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-UTAWNESASA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21?,23+,24+,27?,28?,29?,30?,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 8707,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 8708,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CQYQDAFJSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24-,27-,28+,29-,30+,32+,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ranunculoides,5737826.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ranunculoides'],6,0,6.0 8709,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CQYQDAFJSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24-,27-,28+,29-,30+,32+,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum gigas,1014251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum gigas'],6,0,6.0 8710,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-JEUORDJTSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32+,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium shawurense,5737868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium shawurense'],6,0,6.0 8711,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,0,6.0 8712,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,0,6.0 8713,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum umbrosum,625491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum umbrosum'],6,0,6.0 8714,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudolaeve,6131483.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum pseudolaeve'],6,0,6.0 8715,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium cashmerianum,884026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium cashmerianum'],6,0,6.0 8716,720,-1,,,,0.0,MS1_match,SIUYRGJHHSURRD-UHFFFAOYSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)47-5)36(44,32(35)37)29(40)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3",CCN1CC2(COC(=O)c3ccccc3N3C(=O)CC(C)C3=O)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(O)C23)C14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,SIUYRGJHHSURRD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 8717,720,-1,,,,0.0,MS1_match,SIUYRGJHHSURRD-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)47-5)36(44,32(35)37)29(40)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](O)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,SIUYRGJHHSURRD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucescens,70143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucescens'],6,0,6.0 8718,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-UHFFFAOYSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3",CCN1CC2(COC(=O)c3ccccc3N3C(=O)CC(C)C3=O)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359998,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 8719,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 8720,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 8721,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 8722,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 8723,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-UHFFFAOYSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3",CCN1CC2(COC(=O)c3ccccc3N3C(=O)CC(C)C3=O)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359998,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 8724,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 8725,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 8726,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 8727,720,-1,,,,0.0,MS1_match,KPRGJDVXJLTFLK-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(39)35-21-14-20-23(45-3)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KPRGJDVXJLTFLK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,0,6.0 8728,720,-1,,,,0.0,MS1_match,NJEUIUZXNUEPGH-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(45-3)35-21-14-20-23(39)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6O)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,NJEUIUZXNUEPGH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 8729,720,-1,,,,0.0,MS1_match,NJEUIUZXNUEPGH-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(45-3)35-21-14-20-23(39)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6O)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,NJEUIUZXNUEPGH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 8730,720,-1,,,,0.0,MS1_match,NJEUIUZXNUEPGH-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(45-3)35-21-14-20-23(39)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6O)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,NJEUIUZXNUEPGH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 8731,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum umbrosum,625491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum umbrosum'],6,0,6.0 8732,720,-1,,,,0.0,MS1_match,NJEUIUZXNUEPGH-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(45-3)35-21-14-20-23(39)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6O)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,NJEUIUZXNUEPGH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium,518366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Unknown'],6,0,6.0 8733,720,-1,,,,0.0,MS1_match,NJEUIUZXNUEPGH-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(40)13-18(2)30(38)41)12-11-24(45-3)35-21-14-20-23(39)15-34(43,26(21)27(20)46-4)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,39,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6O)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,NJEUIUZXNUEPGH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 8734,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-JEUORDJTSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32+,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium shawurense,5737868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium shawurense'],6,0,6.0 8735,720,-1,,,,0.0,MS1_match,NCPUFUMYGPQEOY-SVPNHDCUSA-N,"InChI=1S/C38H60O11/c1-18-15-20-29(33(5,6)47-19(2)40)49-38(48-20)28(18)34(7)13-14-37-17-36(37)12-11-24(46-30-27(43)26(42)25(41)21(16-39)45-30)32(3,4)22(36)9-10-23(37)35(34,8)31(38)44/h18,20-31,39,41-44H,9-17H2,1-8H3/t18-,20-,21-,22+,23+,24+,25+,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38+/m1/s1",CC(=O)OC(C)(C)[C@H]1O[C@@]23O[C@@H]1C[C@@H](C)[C@@H]2[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@H]3O,C38H60O11,pos_1_sodium,692.41356274,NCPUFUMYGPQEOY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 8736,720,-1,,,,0.0,MS1_match,NCPUFUMYGPQEOY-UHFFFAOYSA-N,"InChI=1S/C38H60O11/c1-18-15-20-29(33(5,6)47-19(2)40)49-38(48-20)28(18)34(7)13-14-37-17-36(37)12-11-24(46-30-27(43)26(42)25(41)21(16-39)45-30)32(3,4)22(36)9-10-23(37)35(34,8)31(38)44/h18,20-31,39,41-44H,9-17H2,1-8H3",CC(=O)OC(C)(C)C1OC23OC1CC(C)C2C1(C)CCC24CC25CCC(OC2OC(CO)C(O)C(O)C2O)C(C)(C)C5CCC4C1(C)C3O,C38H60O11,pos_1_sodium,692.41356274,NCPUFUMYGPQEOY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 8737,720,-1,,,,0.0,MS1_match,NCPUFUMYGPQEOY-IOJKHVKYSA-N,"InChI=1S/C38H60O11/c1-18-15-20-29(33(5,6)47-19(2)40)49-38(48-20)28(18)34(7)13-14-37-17-36(37)12-11-24(46-30-27(43)26(42)25(41)21(16-39)45-30)32(3,4)22(36)9-10-23(37)35(34,8)31(38)44/h18,20-31,39,41-44H,9-17H2,1-8H3/t18-,20-,21-,22+,23+,24+,25-,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38+/m1/s1",CC(=O)OC(C)(C)[C@H]1O[C@@]23O[C@@H]1C[C@@H](C)[C@@H]2[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@H]3O,C38H60O11,pos_1_sodium,692.41356274,NCPUFUMYGPQEOY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8738,720,-1,,,,0.0,MS1_match,NCPUFUMYGPQEOY-IOJKHVKYSA-N,"InChI=1S/C38H60O11/c1-18-15-20-29(33(5,6)47-19(2)40)49-38(48-20)28(18)34(7)13-14-37-17-36(37)12-11-24(46-30-27(43)26(42)25(41)21(16-39)45-30)32(3,4)22(36)9-10-23(37)35(34,8)31(38)44/h18,20-31,39,41-44H,9-17H2,1-8H3/t18-,20-,21-,22+,23+,24+,25-,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38+/m1/s1",CC(=O)OC(C)(C)[C@H]1O[C@@]23O[C@@H]1C[C@@H](C)[C@@H]2[C@@]1(C)CC[C@@]24C[C@@]25CC[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@H]3O,C38H60O11,pos_1_sodium,692.41356274,NCPUFUMYGPQEOY,Terpenoids,Triterpenoids,Cucurbitane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8739,720,-1,,,,0.0,MS1_match,JJQWNJKBKYZYPG-PLYCVDNSSA-N,"InChI=1S/C38H60O11/c1-19-16-22(29(47-20(2)39)33(5,6)45-9)49-38(44)28(19)34(7)14-15-37-18-36(37)13-12-25(48-30-27(42)26(41)21(40)17-46-30)32(3,4)23(36)10-11-24(37)35(34,8)31(38)43/h11,19,21-23,25-31,40-44H,10,12-18H2,1-9H3/t19-,21-,22+,23-,25+,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38-/m1/s1",COC(C)(C)[C@@H](OC(C)=O)[C@@H]1C[C@@H](C)[C@H]2[C@@](O)(O1)[C@H](O)[C@@]1(C)C3=CC[C@@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C,C38H60O11,pos_1_sodium,692.41356274,JJQWNJKBKYZYPG,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8740,720,-1,,,,0.0,MS1_match,JJQWNJKBKYZYPG-PLYCVDNSSA-N,"InChI=1S/C38H60O11/c1-19-16-22(29(47-20(2)39)33(5,6)45-9)49-38(44)28(19)34(7)14-15-37-18-36(37)13-12-25(48-30-27(42)26(41)21(40)17-46-30)32(3,4)23(36)10-11-24(37)35(34,8)31(38)43/h11,19,21-23,25-31,40-44H,10,12-18H2,1-9H3/t19-,21-,22+,23-,25+,26+,27-,28-,29+,30+,31-,34-,35-,36-,37+,38-/m1/s1",COC(C)(C)[C@@H](OC(C)=O)[C@@H]1C[C@@H](C)[C@H]2[C@@](O)(O1)[C@H](O)[C@@]1(C)C3=CC[C@@H]4C(C)(C)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]21C,C38H60O11,pos_1_sodium,692.41356274,JJQWNJKBKYZYPG,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 8741,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 8742,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 8743,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 8744,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucum,931149.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucum'],6,0,6.0 8745,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium occidentale,3944974.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium occidentale'],6,0,6.0 8746,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,0,6.0 8747,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,0,6.0 8748,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 8749,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbatum,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 8750,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium semibarbartum,3944980.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbartum'],6,0,6.0 8751,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium zalil,224726.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium semibarbatum'],6,0,6.0 8752,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucescens,70143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucescens'],6,0,6.0 8753,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium scabriflorum,6131796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium scabriflorum'],6,0,6.0 8754,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-FPHKUYHXSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18?,20-,21-,23+,24+,26-,27+,28-,29+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CC(C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium,518366.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Unknown'],6,0,6.0 8755,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-IPVNYRSLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32-,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,0,6.0 8756,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-UTAWNESASA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21?,23+,24+,27?,28?,29?,30?,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@@]34C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(C(OC)C23)C14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,0,6.0 8757,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CPIHIRBUSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24+,27-,28+,29-,30+,32?,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2OC,C36H48N2O10,pos_1_1proton1ethylamine,668.3308957359999,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum orientale,586781.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum orientale'],6,0,6.0 8758,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CQYQDAFJSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24-,27-,28+,29-,30+,32+,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum ranunculoides,5737826.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum ranunculoides'],6,0,6.0 8759,720,-1,,,,0.0,MS1_match,KFXVNXQXPRPLQA-CQYQDAFJSA-N,"InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21-,23+,24-,27-,28+,29-,30+,32+,33+,34-,35+,36-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,KFXVNXQXPRPLQA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum gigas,1014251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum gigas'],6,0,6.0 8760,720,-1,,,,0.0,MS1_match,GFWYSOWSJXKFFQ-ITNXDDNLSA-N,"InChI=1S/C36H48N2O10/c1-6-37-16-33(17-48-31(42)19-9-7-8-10-22(19)38-25(39)13-18(2)30(38)41)12-11-24(46-4)35-21-14-20-23(45-3)15-34(43,26(21)27(20)40)36(44,32(35)37)29(47-5)28(33)35/h7-10,18,20-21,23-24,26-29,32,40,43-44H,6,11-17H2,1-5H3/t18-,20+,21+,23-,24-,26+,27-,28+,29-,32?,33-,34+,35-,36+/m0/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@H](C)C3=O)CC[C@H](OC)[C@]34C1[C@](O)([C@@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C36H48N2O10,pos_1_1proton1ethylamine,668.330895736,GFWYSOWSJXKFFQ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium macrocentrum,259368.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium macrocentrum'],6,0,6.0 8761,719,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.5878121,ISDB,GYFNYTZQAFYJEY-QTUDGBRCSA-N,"InChI=1S/C35H40O10/c1-13(12-36)7-24(37)44-35(42)21-10-20(21)32(4)22-9-17-16-8-19(16)33(5)26(17)27(25(28(38)29(33)39)15(3)30(40)43-6)34(22)18(11-23(32)35)14(2)31(41)45-34/h7,16,19-23,27,29,36,39,42H,8-12H2,1-6H3/b13-7+,25-15-/t16-,19-,20-,21+,22+,23-,27+,29+,32-,33+,34?,35-/m1/s1",COC(=O)/C(C)=C1\C(=O)[C@H](O)[C@]2(C)C3=C(C[C@@H]4C5(OC(=O)C(C)=C5C[C@H]5[C@](O)(OC(=O)/C=C(\C)CO)[C@H]6C[C@H]6[C@]45C)[C@H]31)[C@H]1C[C@H]12,C35H40O10,,620.26214748,GYFNYTZQAFYJEY,Terpenoids,Sesquiterpenoids,Cycloeudesmane sesquiterpenoids,Chloranthus fortunei,569911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Chloranthales'],['Chloranthaceae'],['Unknown'],['Chloranthus'],['Chloranthus fortunei'],4,2,7.351248502731323 8762,718,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2760682,ISDB,,,,,,,LXXUHHVICRZHRO,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1042728424072266 8763,717,-1,,,,0.4403939,ISDB,SUPNVGRJWLPVJM-UHFFFAOYSA-N,"InChI=1S/C30H52O4/c1-17(2)30(34)14-13-27(6)20(30)9-12-28(7)24(27)18(31)15-21-26(5)11-10-22(33)25(3,4)23(26)19(32)16-29(21,28)8/h17-24,31-34H,9-16H2,1-8H3",CC(C)C1(O)CCC2(C)C1CCC1(C)C2C(O)CC2C3(C)CCC(O)C(C)(C)C3C(O)CC21C,C30H52O4,,476.386560144,SUPNVGRJWLPVJM,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Mollugo pentaphylla,161911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Molluginaceae'],['Unknown'],['Trigastrotheca'],['Trigastrotheca pentaphylla'],4,0,5.7615755796432495 8764,717,-1,,,,0.4403939,ISDB,SUPNVGRJWLPVJM-UHFFFAOYSA-N,"InChI=1S/C30H52O4/c1-17(2)30(34)14-13-27(6)20(30)9-12-28(7)24(27)18(31)15-21-26(5)11-10-22(33)25(3,4)23(26)19(32)16-29(21,28)8/h17-24,31-34H,9-16H2,1-8H3",CC(C)C1(O)CCC2(C)C1CCC1(C)C2C(O)CC2C3(C)CCC(O)C(C)(C)C3C(O)CC21C,C30H52O4,,476.386560144,SUPNVGRJWLPVJM,Terpenoids,Triterpenoids,Dammarane and Protostane triterpenoids,Trigastrotheca pentaphylla,161911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Molluginaceae'],['Unknown'],['Trigastrotheca'],['Trigastrotheca pentaphylla'],4,0,5.7615755796432495 8765,715,-1,,,,0.40668106,ISDB,,,,,,,GBKIBSMKCVHIKM,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6267242431640625 8766,713,-1,,,,0.21789485,ISDB,LPOVXLVQNSEZGE-PMRPVAAPSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3/t6-,7+,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC(=O)[C@@H]2C,C17H24O10,,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.87157940864563 8767,713,-1,,,,0.21789485,ISDB,LPOVXLVQNSEZGE-UHFFFAOYSA-N,"InChI=1S/C17H24O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,10-14,16-18,20-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12,C17H24O10,,388.1369469679999,LPOVXLVQNSEZGE,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.87157940864563 8768,711,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.80811745,ISDB,IHNKQIMGVNPMTC-RUZDIDTESA-N,"InChI=1S/C26H54NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h25,28H,5-24H2,1-4H3/t25-/m1/s1",CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H54NO7P,,523.3637896979999,IHNKQIMGVNPMTC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,3,5.732469797134399 8769,711,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.80811745,ISDB,IHNKQIMGVNPMTC-RUZDIDTESA-N,"InChI=1S/C26H54NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h25,28H,5-24H2,1-4H3/t25-/m1/s1",CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H54NO7P,,523.3637896979999,IHNKQIMGVNPMTC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Homo sapiens,770315.0,['Eukaryota'],['Metazoa'],['Chordata'],['Mammalia'],['Primates'],['Hominidae'],['Unknown'],['Homo'],['Homo sapiens'],1,3,5.732469797134399 8770,711,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.80811745,ISDB,IHNKQIMGVNPMTC-RUZDIDTESA-N,"InChI=1S/C26H54NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h25,28H,5-24H2,1-4H3/t25-/m1/s1",CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H54NO7P,,523.3637896979999,IHNKQIMGVNPMTC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Ailuropoda melanoleuca,872573.0,['Eukaryota'],['Metazoa'],['Chordata'],['Mammalia'],['Carnivora'],['Ursidae'],['Unknown'],['Ailuropoda'],['Ailuropoda melanoleuca'],1,3,5.732469797134399 8771,711,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.80811745,ISDB,IHNKQIMGVNPMTC-RUZDIDTESA-N,"InChI=1S/C26H54NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h25,28H,5-24H2,1-4H3/t25-/m1/s1",CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H54NO7P,,523.3637896979999,IHNKQIMGVNPMTC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Aphis gossypii,1026471.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hemiptera'],['Aphididae'],['Aphidini'],['Aphis'],['Aphis gossypii'],1,3,5.732469797134399 8772,711,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.80811745,ISDB,IHNKQIMGVNPMTC-RUZDIDTESA-N,"InChI=1S/C26H54NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h25,28H,5-24H2,1-4H3/t25-/m1/s1",CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H54NO7P,,523.3637896979999,IHNKQIMGVNPMTC,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Lysiphlebia japonica,697724.0,['Eukaryota'],['Metazoa'],['Arthropoda'],['Insecta'],['Hymenoptera'],['Braconidae'],['Unknown'],['Lysiphlebia'],['Lysiphlebia japonica'],1,3,5.732469797134399 8773,710,-1,,,,0.57140225,ISDB,GNZWXNKZMHJXNU-UHFFFAOYSA-N,"InChI=1S/C7H11NO/c1-6(9)7-4-2-3-5-8-7/h2-5H2,1H3",CC(=O)C1=NCCCC1,C7H11NO,,125.084063972,GNZWXNKZMHJXNU,Alkaloids,,,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,0,6.285609006881714 8774,708,-1,,,,0.0,MS1_match,ASKNNOPNSQXQPY-XIBVQPFYSA-N,"InChI=1S/C28H30O16/c1-10(29)41-25-15(33)8-39-27(23(25)38)40-9-17-19(34)21(36)22(37)28(43-17)44-26-20(35)18-14(32)6-13(31)7-16(18)42-24(26)11-2-4-12(30)5-3-11/h2-7,15,17,19,21-23,25,27-28,30-34,36-38H,8-9H2,1H3/t15-,17+,19+,21-,22+,23-,25-,27-,28-/m0/s1",CC(=O)O[C@@H]1[C@H](O)[C@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)OC[C@@H]1O,C28H30O16,pos_2_1proton1sodium,622.15338488,ASKNNOPNSQXQPY,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Thalictrum atriplex,871204.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum atriplex'],6,0,6.0 8775,707,-1,,,,0.30502918,ISDB,,,,,,,VQGMGYYBHAOTTE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2201167345046997 8776,705,-1,,,,0.0,MS1_match,QEYACURRVKYESS-UHFFFAOYSA-N,"InChI=1S/C21H24NO4/c1-22-11-10-16-17(13-19(24-3)21(26-5)20(16)25-4)18(22)12-14-6-8-15(23-2)9-7-14/h6-11,13H,12H2,1-5H3/q+1",COc1ccc(Cc2c3cc(OC)c(OC)c(OC)c3cc[n+]2C)cc1,C21H24NO4+,pos_1_minus1proton2sodium,354.16998466809,QEYACURRVKYESS,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 8777,705,-1,,,,0.0,MS1_match,AZGCZIGARDCCNC-UHFFFAOYSA-N,"InChI=1S/C21H24NO4/c1-22-11-10-15-13-18(24-3)20(25-4)21(26-5)19(15)17(22)12-14-6-8-16(23-2)9-7-14/h6-11,13H,12H2,1-5H3/q+1",COc1ccc(Cc2c3c(=[O+]C)c(OC)c(OC)cc-3ccn2C)cc1,C21H24NO4+,pos_1_minus1proton2sodium,354.1699846680899,AZGCZIGARDCCNC,Alkaloids,Histidine alkaloids,,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 8778,705,-1,,,,0.0,MS1_match,KKZYXZUXNZXFFZ-HNNXBMFYSA-N,"InChI=1S/C21H24NO4/c1-22(2)6-5-12-8-18(23-3)21(24-4)20-14-10-17-16(25-11-26-17)9-13(14)7-15(22)19(12)20/h8-10,15H,5-7,11H2,1-4H3/q+1/t15-/m0/s1",COc1cc2c3c(c1OC)-c1cc4c(cc1C[C@@H]3[N+](C)(C)CC2)OCO4,C21H24NO4+,pos_1_minus1proton2sodium,354.16998466809,KKZYXZUXNZXFFZ,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum przewalskii,782787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum przewalskii'],6,0,6.0 8779,705,-1,,,,0.0,MS1_match,IPABSWBNWMXCHM-LBOXEOMUSA-N,"InChI=1S/C21H24NO4/c1-22-7-6-14-9-19-20(26-12-25-19)10-15(14)17(22)8-13-4-5-18(23-2)21(24-3)16(13)11-22/h4-5,9-10,17H,6-8,11-12H2,1-3H3/q+1/t17-,22?/m0/s1",COc1ccc2c(c1OC)C[N+]1(C)CCc3cc4c(cc3[C@@H]1C2)OCO4,C21H24NO4+,pos_1_minus1proton2sodium,354.16998466809,IPABSWBNWMXCHM,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 8780,705,-1,,,,0.0,MS1_match,IPABSWBNWMXCHM-LBOXEOMUSA-N,"InChI=1S/C21H24NO4/c1-22-7-6-14-9-19-20(26-12-25-19)10-15(14)17(22)8-13-4-5-18(23-2)21(24-3)16(13)11-22/h4-5,9-10,17H,6-8,11-12H2,1-3H3/q+1/t17-,22?/m0/s1",COc1ccc2c(c1OC)C[N+]1(C)CCc3cc4c(cc3[C@@H]1C2)OCO4,C21H24NO4+,pos_1_minus1proton2sodium,354.16998466809,IPABSWBNWMXCHM,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 8781,704,12,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.6404696,ISDB,ASYWVBBBOMJYAC-DYEAUMGKSA-N,"InChI=1S/C11H12O5/c1-5-3-8-9(7(13)4-15-8)10(14)11(5)16-6(2)12/h4-5,11,13H,3H2,1-2H3/t5-,11-/m0/s1",CC(=O)O[C@@H]1C(=O)c2c(O)coc2C[C@@H]1C,C11H12O5,,224.068473484,ASYWVBBBOMJYAC,Terpenoids,,,Clinopodium ashei,248835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Mentheae'],['Clinopodium'],['Clinopodium ashei'],4,1,7.061878442764282 8782,701,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.9057023,ISDB,SBHXYTNGIZCORC-ZDUSSCGKSA-N,"InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2/t13-/m0/s1",O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c21,C15H12O6,,288.063388104,SBHXYTNGIZCORC,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,3,11.122809171676636 8783,697,-1,,,,0.0,MS1_match,ABSDACFLIMOXJY-INIZCTEOSA-O,"InChI=1S/C20H25NO4/c1-21(2)8-7-14-11-20(25-4)18(23)12-15(14)16(21)9-13-5-6-19(24-3)17(22)10-13/h5-6,10-12,16H,7-9H2,1-4H3,(H-,22,23)/p+1/t16-/m0/s1",COc1ccc(C[C@H]2c3cc(O)c(OC)cc3CC[N+]2(C)C)cc1O,C20H26NO4+,pos_1_1potassium,344.1856347320899,ABSDACFLIMOXJY,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum foliolosum,124406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foliolosum'],6,0,6.0 8784,696,-1,,,,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_sodium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8785,696,-1,,,,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_sodium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8786,696,-1,,,,0.0,MS1_match,UFCLZKMFXSILNL-UHFFFAOYSA-N,"InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1OC(=O)C=Cc1ccc(O)c(O)c1,C25H24O12,pos_1_sodium,516.1267762079999,UFCLZKMFXSILNL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 8787,694,144,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_sodium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 8788,694,144,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_sodium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,3,7.5 8789,693,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DSNCQKUYZOSARM-QVLXMGEUSA-N,"InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(22-10)23-11(18)6-3-8-1-4-9(17)5-2-8/h1-6,10,12-17,19-21H,7H2/b6-3+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O8,pos_1_sodium,326.1001675359999,DSNCQKUYZOSARM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8790,693,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DSNCQKUYZOSARM-QVLXMGEUSA-N,"InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(22-10)23-11(18)6-3-8-1-4-9(17)5-2-8/h1-6,10,12-17,19-21H,7H2/b6-3+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O8,pos_1_sodium,326.1001675359999,DSNCQKUYZOSARM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,0,6.0 8791,691,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1potassium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 8792,691,-1,,,,0.0,MS1_match,SWGKAHCIOQPKFW-JTNORFRNSA-N,"InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H](C(=O)O)[C@@H](O)C(=O)O,C13H12O9,pos_1_1potassium,312.04813196399994,SWGKAHCIOQPKFW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Hydrastis canadensis,1072050.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Hydrastis'],['Hydrastis canadensis'],6,0,6.0 8793,690,84,Terpenoids,Diterpenoids,Terpenoid alkaloids,0.31990507,ISDB,,,,,,,PPWODKDWYWFWSE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2796202898025513 8794,687,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_1proton1ammonium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,1,8.5 8795,687,94,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QLJNETOQFQXTLI-JKUDBEEXSA-N,"InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3/t14-,15-,20-,21-,22+,23-,24+,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O,C26H32O11,pos_1_1proton1ammonium,520.1944618439999,QLJNETOQFQXTLI,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,1,8.5 8796,685,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.6018192,ISDB,VZZQQZMZDJETCS-GUKRZAEASA-N,"InChI=1S/C20H20O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-4,6-9,11-13,21-22,24H,5,10H2,1H3/b9-4+,17-13-",COc1cc(CCC(=O)/C=C(O)/C=C/c2ccc(O)cc2)ccc1O,C20H20O5,,340.13107374,VZZQQZMZDJETCS,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Aframomum letestuanum,791472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Aframomum'],['Aframomum letestuanum'],4,3,7.90727686882019 8797,682,-1,,,,0.6143733,ISDB,IIKZSHPQUJKBQV-UHIISALHSA-N,"InChI=1S/C14H19NO3/c1-17-11-3-2-5-14(8-11)12-7-13(16)18-9-10(12)4-6-15-14/h2-3,7,10-11,15H,4-6,8-9H2,1H3/t10-,11+,14-/m1/s1",CO[C@H]1C=CC[C@]2(C1)NCC[C@@H]1COC(=O)C=C12,C14H19NO3,,249.136493468,IIKZSHPQUJKBQV,Alkaloids,,,Erythrina berteroana,3921474.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Erythrina'],['Erythrina berteroana'],4,0,6.457493305206299 8798,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,3,7.5 8799,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 8800,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,3,7.5 8801,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 8802,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 8803,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-VHNBHZRZSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,3,7.5 8804,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,3,7.5 8805,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,3,7.5 8806,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 8807,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,3,7.5 8808,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 8809,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 8810,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum monticola,625485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum monticola'],6,3,7.5 8811,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum campylorrhynchum,117075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum campylorrhynchum'],6,3,7.5 8812,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudostapfianum,1073593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tuguancunense'],6,3,7.5 8813,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,3,7.5 8814,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-IZGTZTBCSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13+,14+,15-,16-,17-,18+,19-,20+,21-,22-/m0/s1",CCN1C[C@@H]2CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum toxicum,5737811.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum toxicum'],6,3,7.5 8815,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum contortum,909683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum contortum'],6,3,7.5 8816,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UIVVIYORXDFKKO-IGWUHLPXSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)6-5-16(25)22-14(19)9-13(17(22)23)20-7-4-12(8-15(20)22)21(27,11-24)18(20)26/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]12CC[C@@H](C[C@H]14)[C@@](O)(CO)[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,UIVVIYORXDFKKO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,3,7.5 8817,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,UIVVIYORXDFKKO-IGWUHLPXSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)6-5-16(25)22-14(19)9-13(17(22)23)20-7-4-12(8-15(20)22)21(27,11-24)18(20)26/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]12CC[C@@H](C[C@H]14)[C@@](O)(CO)[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,UIVVIYORXDFKKO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,3,7.5 8818,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,KEXOMXFRKYKFSR-UNIHHUBBSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)14-9-13-17(23)21(14,7-5-16(19)25)15-8-12-4-6-20(13,15)18(26)22(12,27)11-24/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)[C@H](O)CC[C@@]34[C@@H]5C[C@@H]6CC[C@]5([C@H](O)[C@]6(O)CO)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566086,KEXOMXFRKYKFSR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,3,7.5 8819,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,3,7.5 8820,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKGMHDMSESOCGT-YISBXEQFSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(27-3)22-12-7-11-14(24)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@H]6O)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKGMHDMSESOCGT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,3,7.5 8821,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 8822,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,3,7.5 8823,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-DSGMTPGBSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,3,7.5 8824,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium poltaratzkii,6131764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium poltaratzkii'],6,3,7.5 8825,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,7.5 8826,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,3,7.5 8827,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,3,7.5 8828,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 8829,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 8830,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 8831,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,3,7.5 8832,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,3,7.5 8833,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 8834,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-VHNBHZRZSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,3,7.5 8835,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,3,7.5 8836,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,3,7.5 8837,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 8838,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,3,7.5 8839,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,3,7.5 8840,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-DSGMTPGBSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,3,7.5 8841,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium poltaratzkii,6131764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium poltaratzkii'],6,3,7.5 8842,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MCH3CNNa,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,3,7.5 8843,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MCH3CNNa,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 8844,680,456,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,MDCQBGQVDRLEGB-SZDRHTRBSA-N,"InChI=1S/C22H35NO4/c1-4-23-11-19(2)7-6-15(27-3)22-14(19)9-13(18(22)23)20(25)8-5-12-10-21(22,26)17(20)16(12)24/h12-18,24-26H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17+,18+,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)CC[C@H]2C[C@]4(O)[C@@H]1[C@H]2O,C22H35NO4,pos_2MCH3CNNa,377.2566086,MDCQBGQVDRLEGB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,3,7.5 8845,678,382,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1acetonitrile,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,7.5 8846,678,382,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1acetonitrile,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,3,7.5 8847,678,382,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1acetonitrile,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Delphinium schmalhausenii,7591251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium schmalhausenii'],6,3,7.5 8848,678,382,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1acetonitrile,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Delphinium fissum,833960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium fissum'],6,3,7.5 8849,677,-1,,,,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_1_1proton1acetonitrile,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8850,677,-1,,,,0.0,MS1_match,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,pos_1_1proton1acetonitrile,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,6.0 8851,677,-1,,,,0.0,MS1_match,SXCVPGXYCJAUPB-YLAKUSLOSA-N,"InChI=1S/C20H32O3/c1-13(2)15-7-8-20(6)11-16(9-14(3)17(20)10-15)23-18(21)12-19(4,5)22/h15-17,22H,1,3,7-12H2,2,4-6H3/t15-,16+,17+,20+/m1/s1",C=C(C)[C@@H]1CC[C@@]2(C)C[C@@H](OC(=O)CC(C)(C)O)CC(=C)[C@@H]2C1,C20H32O3,pos_1_1proton1ammonium,320.235144884,SXCVPGXYCJAUPB,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 8852,675,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.36347097,ISDB,PDIGSOAOQOXRDU-WJPZTBRDSA-N,"InChI=1S/C28H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28(31)34-25-27(30)26-36-37(32,33)35-24-23-29(2,3)4/h6-7,9-10,12-13,15-16,18-19,27,30H,5,8,11,14,17,20-26H2,1-4H3/b7-6-,10-9-,13-12-,16-15-,19-18-/t27-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C28H48NO7P,,541.316839506,PDIGSOAOQOXRDU,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Homo sapiens,770315.0,['Eukaryota'],['Metazoa'],['Chordata'],['Mammalia'],['Primates'],['Hominidae'],['Unknown'],['Homo'],['Homo sapiens'],1,3,3.9538838863372803 8853,674,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.38540804,ISDB,IVMLONFHZYZDNZ-UHFFFAOYSA-N,"InChI=1S/C27H36O/c1-23(2)13-9-16-26(5)18-11-20-27(6)19-10-17-24(3)14-7-8-15-25(4)21-12-22-28/h7-8,10-15,17-22H,9,16H2,1-6H3",CC(C)=CCCC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=O,C27H36O,,376.276615772,IVMLONFHZYZDNZ,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,1,6.041632175445557 8854,671,-1,,,,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton1methanol,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,0,7.0 8855,666,-1,,,,0.0,MS1_match,DBIKJXXBCAHHMC-WOJBJXKFSA-N,"InChI=1S/C20H26O7/c1-25-17-11-14(6-7-15(17)23)20(24)19(12-22)27-16-8-5-13(4-3-9-21)10-18(16)26-2/h5-8,10-11,19-24H,3-4,9,12H2,1-2H3/t19-,20-/m1/s1",COc1cc([C@@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O,C20H26O7,pos_2MNa,378.1678531719999,DBIKJXXBCAHHMC,Shikimates and Phenylpropanoids,Lignans,Neolignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 8856,666,-1,,,,0.0,MS1_match,DBIKJXXBCAHHMC-WOJBJXKFSA-N,"InChI=1S/C20H26O7/c1-25-17-11-14(6-7-15(17)23)20(24)19(12-22)27-16-8-5-13(4-3-9-21)10-18(16)26-2/h5-8,10-11,19-24H,3-4,9,12H2,1-2H3/t19-,20-/m1/s1",COc1cc([C@@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O,C20H26O7,pos_2MNa,378.1678531719999,DBIKJXXBCAHHMC,Shikimates and Phenylpropanoids,Lignans,Neolignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 8857,663,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.7430135,ISDB,LBHQTVBKPMHICN-MDZDMXLPSA-N,"InChI=1S/C20H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10H,2-8,11-19H2,1H3,(H2,21,22)/b10-9+",CCCCCCCC/C=C/CCCCCCCCCC(N)=O,C20H39NO,,309.303164868,LBHQTVBKPMHICN,Fatty acids,Fatty amides,Primary amides,Streptomyces,772892.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Unknown'],0,1,3.4720540046691895 8858,660,-1,,,,0.26163307,ISDB,ZQBLOEFPHMRSSU-UHFFFAOYSA-N,"InChI=1S/C21H32O4/c1-13(22)16-6-11-21(25)19(16,3)9-7-17-18(2)8-5-15(23)12-14(18)4-10-20(17,21)24/h4,15-17,23-25H,5-12H2,1-3H3",CC(=O)C1CCC2(O)C1(C)CCC1C3(C)CCC(O)CC3=CCC12O,C21H32O4,,348.230059504,ZQBLOEFPHMRSSU,Terpenoids,Steroids,Pregnane steroids,Adonis amurensis,243850.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Adonis'],['Adonis amurensis'],6,0,7.0465322732925415 8859,657,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.32515752,ISDB,QQCGKIZHTJLRNN-UHFFFAOYSA-N,"InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23-20-21(2)3/h16-19,21H,4-15,20H2,1-3H3,(H,23,24)",CCCCCCCCCCCCCC=CC=CC(=O)NCC(C)C,C22H41NO,,335.318814932,QQCGKIZHTJLRNN,Fatty acids,Fatty amides,N-acyl amines,Piper nigrum,472526.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper nigrum'],0,1,1.8006300926208496 8860,657,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.32515752,ISDB,QQCGKIZHTJLRNN-UHFFFAOYSA-N,"InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23-20-21(2)3/h16-19,21H,4-15,20H2,1-3H3,(H,23,24)",CCCCCCCCCCCCCC=CC=CC(=O)NCC(C)C,C22H41NO,,335.318814932,QQCGKIZHTJLRNN,Fatty acids,Fatty amides,N-acyl amines,Piper longum,97780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper longum'],0,1,1.8006300926208496 8861,657,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.32515752,ISDB,QQCGKIZHTJLRNN-UHFFFAOYSA-N,"InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23-20-21(2)3/h16-19,21H,4-15,20H2,1-3H3,(H,23,24)",CCCCCCCCCCCCCC=CC=CC(=O)NCC(C)C,C22H41NO,,335.318814932,QQCGKIZHTJLRNN,Fatty acids,Fatty amides,N-acyl amines,Piper retrofractum,505281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper retrofractum'],0,1,1.8006300926208496 8862,657,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.32515752,ISDB,QQCGKIZHTJLRNN-UHFFFAOYSA-N,"InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23-20-21(2)3/h16-19,21H,4-15,20H2,1-3H3,(H,23,24)",CCCCCCCCCCCCCC=CC=CC(=O)NCC(C)C,C22H41NO,,335.318814932,QQCGKIZHTJLRNN,Fatty acids,Fatty amides,N-acyl amines,Piper chaba,505281.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper retrofractum'],0,1,1.8006300926208496 8863,657,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.32515752,ISDB,QQCGKIZHTJLRNN-UHFFFAOYSA-N,"InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23-20-21(2)3/h16-19,21H,4-15,20H2,1-3H3,(H,23,24)",CCCCCCCCCCCCCC=CC=CC(=O)NCC(C)C,C22H41NO,,335.318814932,QQCGKIZHTJLRNN,Fatty acids,Fatty amides,N-acyl amines,Piper guineense,233005.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper guineense'],0,1,1.8006300926208496 8864,657,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.32515752,ISDB,QQCGKIZHTJLRNN-UHFFFAOYSA-N,"InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23-20-21(2)3/h16-19,21H,4-15,20H2,1-3H3,(H,23,24)",CCCCCCCCCCCCCC=CC=CC(=O)NCC(C)C,C22H41NO,,335.318814932,QQCGKIZHTJLRNN,Fatty acids,Fatty amides,N-acyl amines,Piper sarmentosum,183522.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper sarmentosum'],0,1,1.8006300926208496 8865,655,24,Terpenoids,Diterpenoids,Guaiane sesquiterpenoids,0.53482896,ISDB,PMDCKDXMRHEFLJ-YJRNTSOCSA-N,"InChI=1S/C27H44O8/c1-7-9-10-11-12-13-14-15-23(28)35-24-21(33-25(29)18(3)4)16-20(27(31)32-6)17-22(24)34-26(30)19(5)8-2/h17-19,21-22,24H,7-16H2,1-6H3/t19-,21-,22-,24+/m1/s1",CCCCCCCCCC(=O)O[C@@H]1[C@H](OC(=O)[C@H](C)CC)C=C(C(=O)OC)C[C@H]1OC(=O)C(C)C,C27H44O8,,496.303618368,PMDCKDXMRHEFLJ,Terpenoids,,,Senecio lividus,962482.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Senecio'],['Senecio lividus'],4,1,6.639315843582153 8866,654,221,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,0.72518885,ISDB,OPURFTKJCNDEDB-UOLJMSNASA-N,"InChI=1S/C14H14O7/c1-14(19)11(7-20-13(14)18)21-12(17)5-3-8-2-4-9(15)10(16)6-8/h2-6,11,15-16,19H,7H2,1H3/b5-3+/t11-,14-/m1/s1",C[C@]1(O)C(=O)OC[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1,C14H14O7,,294.073952788,OPURFTKJCNDEDB,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Bidens pilosa,315599.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Coreopsideae'],['Bidens'],['Bidens pilosa'],4,1,7.400755405426025 8867,652,-1,,,,0.0,MS1_match,ZJSJQWDXAYNLNS-FUPWJLLWSA-N,"InChI=1S/C32H42O16/c1-41-19-7-13(3-5-17(19)45-31-27(39)25(37)23(35)21(9-33)47-31)29-15-11-44-30(16(15)12-43-29)14-4-6-18(20(8-14)42-2)46-32-28(40)26(38)24(36)22(10-34)48-32/h3-8,15-16,21-40H,9-12H2,1-2H3/t15-,16-,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H42O16,pos_1_sodium,682.2472852640001,ZJSJQWDXAYNLNS,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8868,652,-1,,,,0.0,MS1_match,ZJSJQWDXAYNLNS-FUPWJLLWSA-N,"InChI=1S/C32H42O16/c1-41-19-7-13(3-5-17(19)45-31-27(39)25(37)23(35)21(9-33)47-31)29-15-11-44-30(16(15)12-43-29)14-4-6-18(20(8-14)42-2)46-32-28(40)26(38)24(36)22(10-34)48-32/h3-8,15-16,21-40H,9-12H2,1-2H3/t15-,16-,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H42O16,pos_1_sodium,682.2472852640001,ZJSJQWDXAYNLNS,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8869,649,1373,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,0.56951433,ISDB,KJSAXQYTHNRIBJ-YRGRVCCFSA-N,"InChI=1S/C14H20O2/c1-10(13(15)16)11-6-8-14(2)7-4-3-5-12(14)9-11/h3,5,11-12H,1,4,6-9H2,2H3,(H,15,16)/t11-,12-,14-/m1/s1",C=C(C(=O)O)[C@@H]1CC[C@@]2(C)CCC=C[C@@H]2C1,C14H20O2,,220.14632988,KJSAXQYTHNRIBJ,Terpenoids,Sesquiterpenoids,Eudesmane sesquiterpenoids,Dittrichia graveolens,3899100.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Dittrichia'],['Dittrichia graveolens'],4,3,7.778057336807251 8870,648,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.81009275,ISDB,SYFFHZSTXDTJOS-VXYATBKXSA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(50-9)48-7-16-20(39)24(43)27(46)32(52-16)49-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(34)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16-,17-,19-,20-,21+,23+,24+,25+,26+,27-,28-,31-,32-,33+/m0/s1",C[C@@H]1O[C@H](OC[C@@H]2O[C@H](OC[C@@H]3O[C@H](Oc4c(-c5ccc(O)c(O)c5)oc5cc(O)cc(O)c5c4=O)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,,772.2062083,SYFFHZSTXDTJOS,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Albizia lebbeck,555517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Ingeae'],['Albizia'],['Albizia lebbeck'],4,3,8.740370988845825 8871,648,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.81009275,ISDB,SYFFHZSTXDTJOS-OQNXJHIZSA-N,"InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(50-9)48-7-16-20(39)24(43)27(46)32(52-16)49-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(34)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,28+,31+,32+,33?/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC[C@H]3OC(Oc4c(-c5ccc(O)c(O)c5)oc5cc(O)cc(O)c5c4=O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C33H40O21,,772.2062083,SYFFHZSTXDTJOS,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Capparis spinosa,97170.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Capparaceae'],['Unknown'],['Capparis'],['Capparis spinosa'],4,3,8.740370988845825 8872,647,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,QFANMAOKAWEBQA-UHFFFAOYSA-N,"InChI=1S/C20H32O2/c1-13(2)10-19(21)22-12-14(3)11-17-8-6-15(4)18-9-7-16(5)20(17)18/h11,13,15,17-18H,6-10,12H2,1-5H3",CC(=CC1CCC(C)C2CCC(C)=C12)COC(=O)CC(C)C,C20H32O2,pos_1_1proton1ammonium,304.240230264,QFANMAOKAWEBQA,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8873,647,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,OLAKPNFIICOONC-VHSXEESVSA-N,"InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6,9-11H,1,4-5H2,2-3H3/t9-,10+/m0/s1",C=C(C)[C@@H]1CCC(C)=C[C@H]1O,C10H16O,pos_2MHNH3,152.120115132,OLAKPNFIICOONC,Terpenoids,Monoterpenoids,Menthane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8874,647,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,DSSYKIVIOFKYAU-XVKPBYJWSA-N,"InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10-/m0/s1",CC1(C)[C@H]2CC[C@@]1(C)C(=O)C2,C10H16O,pos_2MHNH3,152.120115132,DSSYKIVIOFKYAU,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8875,647,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,RXBQNMWIQKOSCS-UHFFFAOYSA-N,"InChI=1S/C10H16O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,8-9,11H,4-6H2,1-2H3",CC1(C)C2CC=C(CO)C1C2,C10H16O,pos_2MHNH3,152.120115132,RXBQNMWIQKOSCS,Terpenoids,Monoterpenoids,Pinane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 8876,644,-1,,,,0.7455328,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,0,6.982131242752075 8877,642,-1,,,,0.0,MS1_match,KNFOHFRALRKTOJ-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_1potassium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8878,642,-1,,,,0.0,MS1_match,KNFOHFRALRKTOJ-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc(C[C@@H]2CO[C@@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_1potassium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 8879,642,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_1potassium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8880,642,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_1potassium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 8881,642,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_1potassium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8882,642,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_1potassium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 8883,641,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,FXHGMKSSBGDXIY-UHFFFAOYSA-N,"InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3",CCCCCCC=O,C7H14O,pos_2MHNH3,114.104465068,FXHGMKSSBGDXIY,Fatty acids,Fatty acyls,Fatty aldehydes,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 8884,640,-1,,,,0.0,MS1_match,JGYRCOIPRDVLMU-YNLINXDKSA-N,"InChI=1S/C25H41NO4/c1-6-26-13-23(3)9-8-19(29-5)25-15-10-14-17(28-4)12-24(30-7-2,20(15)21(14)27)16(22(25)26)11-18(23)25/h14-22,27H,6-13H2,1-5H3/t14-,15-,16+,17+,18-,19+,20-,21+,22-,23+,24+,25-/m1/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3O)[C@@]13[C@@H](OC)CC[C@@]4(C)CN(CC)[C@@H]1[C@@H]2C[C@H]43,C25H41NO4,pos_1_1proton,419.3035587919999,JGYRCOIPRDVLMU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 8885,639,-1,,,,0.24731132,ISDB,LAXIYINGQJWPCG-OHDICMOHSA-N,"InChI=1S/C19H20O4/c1-18-8-6-13-17(21)23-14(12-7-9-22-11-12)10-19(13,2)15(18)4-3-5-16(18)20/h3,5-7,9,11,14-15H,4,8,10H2,1-2H3/t14-,15-,18-,19-/m1/s1",C[C@@]12CC=C3C(=O)O[C@@H](c4ccoc4)C[C@@]3(C)[C@@H]1CC=CC2=O,C19H20O4,,312.13615911999995,LAXIYINGQJWPCG,Terpenoids,Diterpenoids,,Fibraurea tinctoria,678311.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Menispermaceae'],['Burasaieae'],['Fibraurea'],['Fibraurea tinctoria'],5,0,5.989245295524597 8886,638,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_sodium,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8887,638,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_sodium,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8888,638,-1,,,,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_sodium,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 8889,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 8890,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus sphaerospermus,1033259.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sphaerospermus'],6,3,7.5 8891,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis var. diffusus,5264025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 8892,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus aquatilis,491491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus aquatilis'],6,3,7.5 8893,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus penicillatus,492327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus penicillatus'],6,3,7.5 8894,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 8895,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 8896,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus rionii,593374.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus rionii'],6,3,7.5 8897,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BNSCASRSSGJHQH-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-9-4-12(32)16-13(5-9)41-24(8-1-2-10(30)11(31)3-8)25(19(16)35)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,BNSCASRSSGJHQH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 8898,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,BNSCASRSSGJHQH-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-9-4-12(32)16-13(5-9)41-24(8-1-2-10(30)11(31)3-8)25(19(16)35)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,BNSCASRSSGJHQH,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus peltatus,816424.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus peltatus'],6,3,7.5 8899,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 8900,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 8901,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,FDRQPMVGJOQVTL-DEFKTLOSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,FDRQPMVGJOQVTL,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 8902,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 8903,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 8904,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus biternatus,692884.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus biternatus'],6,3,7.5 8905,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus moseleyi,6132641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus moseleyi'],6,3,7.5 8906,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,UTECWQIXBMWRRR-QXHWVZJPSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)19(36)21(38)26(41-14)43-24-15(7-29)42-27(22(39)20(24)37)44-25-18(35)16-12(33)4-9(30)5-13(16)40-23(25)8-1-2-10(31)11(32)3-8/h1-5,14-15,17,19-22,24,26-34,36-39H,6-7H2/t14-,15-,17-,19+,20-,21-,22-,24-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995000001,UTECWQIXBMWRRR,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus pseudotrullifolius,456902.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus pseudotrullifolius'],6,3,7.5 8907,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-UJECXLDQSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1",O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus hederaceus,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 8908,635,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RDUAJIJVNHKTQC-IROKYFGSSA-N,"InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14?,15?,17-,18-,20?,21?,22-,25?,26+,27+/m1/s1",O=c1c(O[C@@H]2OC(CO)[C@@H](O)C(O)C2O[C@@H]2OC(CO)[C@@H](O)C(O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C27H30O17,pos_1_1proton,626.1482995,RDUAJIJVNHKTQC,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Ranunculus ololeucos,566818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus hederaceus'],6,3,7.5 8909,634,-1,,,,0.56019986,ISDB,WSIGIYXRBYAAKJ-VMCMIOPMSA-N,"InChI=1S/C31H46O4/c1-26(2)23(33)11-12-29(5)22-10-9-19-20-17-28(4,25(34)35-8)14-13-27(20,3)15-16-30(19,6)31(22,7)18-21(32)24(26)29/h9-10,20,23-24,33H,11-18H2,1-8H3/t20-,23-,24-,27+,28+,29+,30+,31+/m0/s1",COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC=C4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5C(=O)C[C@]43C)[C@@H]2C1,C31H46O4,,482.339609952,WSIGIYXRBYAAKJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Glycyrrhiza triphylla,88616.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Glycyrrhiza'],['Glycyrrhiza triphylla'],4,0,6.240799427032471 8910,632,-1,,,,0.6227678,ISDB,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,8.491071224212646 8911,632,-1,,,,0.6227678,ISDB,NPDSHTNEKLQQIJ-ZJHFMPGASA-N,"InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+",CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O,C18H32O3,,296.235144884,NPDSHTNEKLQQIJ,Fatty acids,Octadecanoids,Other Octadecanoids,Valeriana fauriei,228778.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana fauriei'],6,0,8.491071224212646 8912,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum volubile,549540.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum volubile'],6,3,7.5 8913,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 8914,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,3,7.5 8915,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,3,7.5 8916,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nevadense,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,3,7.5 8917,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,3,7.5 8918,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,3,7.5 8919,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 8920,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 8921,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 8922,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,3,7.5 8923,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum henryi,5511349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum henryi'],6,3,7.5 8924,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,3,7.5 8925,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-ISYHQGQGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13?,14-,15+,16?,17-,18?,19?,20?,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CCC(OC)C34C1C(C(OC)[C@@H]32)[C@@]1(O)C[C@H](OC)C2C[C@@H]4[C@@H]1C2O,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 8926,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 8927,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 8928,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-VYPGSPFBSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15-,16-,17-,18+,19-,20-,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,3,7.5 8929,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,3,7.5 8930,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,3,7.5 8931,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JBMHRENUZHIXEX-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-7-26-12-22(2)9-8-16(30-4)24-14-10-13-15(29-3)11-23(27,17(14)18(13)31-5)25(28,21(24)26)20(32-6)19(22)24/h13-21,27-28H,7-12H2,1-6H3",CCN1CC2(C)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.293388032,JBMHRENUZHIXEX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium grandiflorum,1004833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium grandiflorum'],6,3,7.5 8932,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JBMHRENUZHIXEX-KCOJYJFYSA-N,"InChI=1S/C25H41NO6/c1-7-26-12-22(2)9-8-16(30-4)24-14-10-13-15(29-3)11-23(27,17(14)18(13)31-5)25(28,21(24)26)20(32-6)19(22)24/h13-21,27-28H,7-12H2,1-6H3/t13-,14-,15+,16+,17-,18-,19+,20+,21-,22-,23-,24-,25+/m0/s1",CCN1C[C@]2(C)CC[C@@H](OC)[C@@]34[C@@H]2[C@@H](OC)[C@@](O)([C@@H]13)[C@]1(O)C[C@@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2OC,C25H41NO6,pos_1_1proton1methanol,451.293388032,JBMHRENUZHIXEX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium dissectum,6131641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium dissectum'],6,3,7.5 8933,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JBMHRENUZHIXEX-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-7-26-12-22(2)9-8-16(30-4)24-14-10-13-15(29-3)11-23(27,17(14)18(13)31-5)25(28,21(24)26)20(32-6)19(22)24/h13-21,27-28H,7-12H2,1-6H3",CCN1CC2(C)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.293388032,JBMHRENUZHIXEX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium confusum,6131625.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium confusum'],6,3,7.5 8934,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VBOMZXYQMCEYLU-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-27)8-7-16(30-3)25-14-9-13-15(29-2)10-24(28,17(14)19(13)31-4)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,VBOMZXYQMCEYLU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum septentrionale,586782.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum septentrionale'],6,3,7.5 8935,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tatsienense,413958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tatsienense'],6,3,7.5 8936,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sungpanense,1042521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sungpanense'],6,3,7.5 8937,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,3,7.5 8938,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 8939,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 8940,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum transsectum,909685.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum transsectum'],6,3,7.5 8941,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sungpanense,1042521.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sungpanense'],6,3,7.5 8942,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum henryi,5511349.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum henryi'],6,3,7.5 8943,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum hemsleyanum,511674.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum hemsleyanum'],6,3,7.5 8944,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,3,7.5 8945,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,3,7.5 8946,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum nevadense,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,3,7.5 8947,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum burnatii,3944952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum burnatii'],6,3,7.5 8948,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum balfourii,698586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum balfourii'],6,3,7.5 8949,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,3,7.5 8950,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 8951,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,3,7.5 8952,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum triphyllum,6131530.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum triphyllum'],6,3,7.5 8953,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,3,7.5 8954,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-UHFFFAOYSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3",CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum tatsienense,413958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tatsienense'],6,3,7.5 8955,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-ISYHQGQGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13?,14-,15+,16?,17-,18?,19?,20?,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CCC(OC)C34C1C(C(OC)[C@@H]32)[C@@]1(O)C[C@H](OC)C2C[C@@H]4[C@@H]1C2O,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,3,7.5 8956,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 8957,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,3,7.5 8958,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-VYPGSPFBSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15-,16-,17-,18+,19-,20-,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@H]6OC)[C@@H]([C@@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium stapeliosum,6131808.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium stapeliosum'],6,3,7.5 8959,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum,756111.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Unknown'],6,3,7.5 8960,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-RIVIBFSZSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22?,23+,24-,25+/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H]([C@H](OC)[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.2933880319999,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum episcopale,50065.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum episcopale'],6,3,7.5 8961,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DBODJJZRZFZBBD-WDTQSPAGSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18?,19+,20+,21-,22?,23+,24-,25?/m1/s1",CCN1C[C@]2(COC)CC[C@H](OC)C34C1C([C@H](OC)[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.293388032,DBODJJZRZFZBBD,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum volubile,549540.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum volubile'],6,3,7.5 8962,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,VBOMZXYQMCEYLU-XXYWQWTJSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-27)8-7-16(30-3)25-14-9-13-15(29-2)10-24(28,17(14)19(13)31-4)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1",CCN1C[C@]2(CO)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H]([C@H](OC)[C@H]23)[C@@H]14,C25H41NO6,pos_1_1proton1methanol,451.293388032,VBOMZXYQMCEYLU,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lycoctonum,14055.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lycoctonum'],6,3,7.5 8963,631,1213,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,DFEZSQMRHFPRME-LNEJQENQSA-N,"InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(27)25-14-9-13-15(30-3)10-24(32-5,17(14)19(13)28)18(22(25)26)20(31-4)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-,25-/m0/s1",CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@@H]13)[C@]1(OC)C[C@H](OC)[C@@H]2C[C@H]4[C@H]1[C@H]2O,C25H41NO6,pos_1_1proton1methanol,451.293388032,DFEZSQMRHFPRME,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,3,7.5 8964,628,-1,,,,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1potassium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 8965,628,-1,,,,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1potassium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 8966,628,-1,,,,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1potassium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 8967,628,-1,,,,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1potassium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 8968,628,-1,,,,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1potassium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 8969,628,-1,,,,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1potassium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,0,8.0 8970,625,-1,,,,0.0,MS1_match,HKMDHBXRMZEVHY-UHFFFAOYSA-N,"InChI=1S/C16H26O8/c1-7-8-3-4-16(2,9(8)6-22-14(7)21)24-15-13(20)12(19)11(18)10(5-17)23-15/h7-13,15,17-20H,3-6H2,1-2H3",CC1C(=O)OCC2C1CCC2(C)OC1OC(CO)C(O)C(O)C1O,C16H26O8,pos_1_sodium,346.1627677919999,HKMDHBXRMZEVHY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,0,6.0 8971,625,-1,,,,0.0,MS1_match,PLSSBWGEYMENGJ-XLIFQNPRSA-N,"InChI=1S/C16H26O8/c1-7-2-3-9-8(5-22-15(21)11(7)9)6-23-16-14(20)13(19)12(18)10(4-17)24-16/h7-14,16-20H,2-6H2,1H3/t7-,8+,9+,10+,11+,12+,13+,14-,16+/m0/s1",C[C@H]1CC[C@@H]2[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)COC(=O)[C@@H]21,C16H26O8,pos_1_sodium,346.162767792,PLSSBWGEYMENGJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,0,6.0 8972,624,671,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,WEKCEGQSIIQPAQ-UHFFFAOYSA-N,"InChI=1S/C28H36O13/c1-34-16-5-12(6-17(35-2)21(16)30)25-14-10-39-26(15(14)11-38-25)13-7-18(36-3)27(19(8-13)37-4)41-28-24(33)23(32)22(31)20(9-29)40-28/h5-8,14-15,20,22-26,28-33H,9-11H2,1-4H3",COc1cc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)cc(OC)c1O,C28H36O13,pos_1_sodium,580.215591212,WEKCEGQSIIQPAQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 8973,624,671,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,WEKCEGQSIIQPAQ-UHFFFAOYSA-N,"InChI=1S/C28H36O13/c1-34-16-5-12(6-17(35-2)21(16)30)25-14-10-39-26(15(14)11-38-25)13-7-18(36-3)27(19(8-13)37-4)41-28-24(33)23(32)22(31)20(9-29)40-28/h5-8,14-15,20,22-26,28-33H,9-11H2,1-4H3",COc1cc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)cc(OC)c1O,C28H36O13,pos_1_sodium,580.215591212,WEKCEGQSIIQPAQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 8974,624,671,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,WEKCEGQSIIQPAQ-UHFFFAOYSA-N,"InChI=1S/C28H36O13/c1-34-16-5-12(6-17(35-2)21(16)30)25-14-10-39-26(15(14)11-38-25)13-7-18(36-3)27(19(8-13)37-4)41-28-24(33)23(32)22(31)20(9-29)40-28/h5-8,14-15,20,22-26,28-33H,9-11H2,1-4H3",COc1cc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)cc(OC)c1O,C28H36O13,pos_1_sodium,580.215591212,WEKCEGQSIIQPAQ,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 8975,623,51,Polyketides,Linear polyketides,Acetogenins,0.33817428,ISDB,DJVQAKQVQXIHEL-UHFFFAOYSA-N,"InChI=1S/C43H74O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11-14,17-19,22,36-37,40-44,47-49H,3-10,15-16,20-21,23-35H2,1-2H3",CCCCCC=CCC=CCCCCCCCC(=O)OCC(COC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCCC=CCC=CCCCCC,C43H74O10,,750.5281985679999,DJVQAKQVQXIHEL,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Chlorella vulgaris,804978.0,['Eukaryota'],['Archaeplastida'],['Chlorophyta'],['Trebouxiophyceae'],['Chlorellales'],['Chlorellaceae'],['Unknown'],['Chlorella'],['Chlorella vulgaris'],2,0,3.3526971340179443 8976,621,1056,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.29658312,ISDB,IUSBVFZKQJGVEP-SNAWJCMRSA-N,"InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+",C/C=C/c1ccc(OC(C)=O)c(OC)c1,C12H14O3,,206.094294308,IUSBVFZKQJGVEP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,8.68633246421814 8977,620,217,,,,0.27908534,ISDB,,,,,,,LDPJFEPYYCUUOO,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.1163413524627686 8978,617,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.58376443,ISDB,RITHLQKJQSKUAO-ROUUACIJSA-N,"InChI=1S/C19H38O4/c1-3-4-5-6-8-11-14-17(20)18(21)15-12-9-7-10-13-16-19(22)23-2/h17-18,20-21H,3-16H2,1-2H3/t17-,18-/m0/s1",CCCCCCCC[C@H](O)[C@@H](O)CCCCCCCC(=O)OC,C19H38O4,,330.277009696,RITHLQKJQSKUAO,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,Shorea robusta,109362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Dipterocarpaceae'],['Unknown'],['Shorea'],['Shorea robusta'],4,3,7.835057735443115 8979,616,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.5764149,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea prunifolia,7606947.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea prunifolia'],4,3,7.805659532546997 8980,616,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.5764149,ISDB,XFSSKYLJQBBIKJ-UHFFFAOYSA-N,"InChI=1S/C11H12O4/c1-7(2)5-11(14)15-10-6-8(12)3-4-9(10)13/h3-6,12-13H,1-2H3",CC(C)=CC(=O)Oc1cc(O)ccc1O,C11H12O4,,208.073558864,XFSSKYLJQBBIKJ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Calea jamaicensis,431707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea jamaicensis'],4,3,7.805659532546997 8981,611,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.2103558,ISDB,DVNMUVHPUGDIPW-AAYWPADASA-N,"InChI=1S/C26H30O10/c1-11-26(30)25(20(29)31-6)17-18(33-11)34-19(28)22(17,4)9-14-23(25,5)15(35-26)7-12-13(24(14)10-32-24)8-16(27)36-21(12,2)3/h7-8,11,14-15,17-18,30H,9-10H2,1-6H3/t11-,14-,15+,17-,18-,22-,23-,24+,25+,26-/m0/s1",COC(=O)[C@]12[C@H]3[C@@H]4OC(=O)[C@@]3(C)C[C@H]3[C@@]1(C)[C@@H](C=C1C(=CC(=O)OC1(C)C)[C@]31CO1)O[C@@]2(O)[C@H](C)O4,C26H30O10,,502.1838971599998,DVNMUVHPUGDIPW,Polyketides,Meroterpenoids,Tetraketide meroterpenoids,Penicillium purpurogenum,5310739.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium purpurogenum'],1,0,1.841423213481903 8982,610,325,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.55890906,ISDB,ZCKDCRKBURQZPT-UHFFFAOYSA-N,"InChI=1S/C9H10O3/c10-5-1-2-7-3-4-8(11)9(12)6-7/h1-4,6,10-12H,5H2",OCC=Cc1ccc(O)c(O)c1,C9H10O3,,166.06299418,ZCKDCRKBURQZPT,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,7.735636234283447 8983,609,-1,,,,0.4256188,ISDB,RGHHSNMVTDWUBI-UHFFFAOYSA-N,"InChI=1S/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9H",O=Cc1ccc(O)cc1,C7H6O2,,122.036779432,RGHHSNMVTDWUBI,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Shikimic acids and derivatives,Viburnum dilatatum,205155.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum dilatatum'],5,0,6.702475190162659 8984,607,-1,,,,0.26580182,ISDB,,,,,,,HGXSLICBELZODC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0632072687149048 8985,604,-1,,,,0.2049571,ISDB,DXQGHBIXJLKBGR-SANMLTNESA-N,"InChI=1S/C29H50O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-26(30)24-29(33)34-22-17-18-25-20-21-27(31)28(32)23-25/h20-21,23,26,30-32H,2-19,22,24H2,1H3/t26-/m0/s1",CCCCCCCCCCCCCCCCC[C@H](O)CC(=O)OCCCc1ccc(O)c(O)c1,C29H50O5,,478.3658247,DXQGHBIXJLKBGR,Polyketides,Aromatic polyketides,Catechols with side chains,Pegolettia senegalensis,782981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Inuleae'],['Pegolettia'],['Pegolettia senegalensis'],4,0,4.819828391075134 8986,602,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton1ammonium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 8987,602,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton1ammonium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 8988,597,63,Terpenoids,Small peptides,Secoiridoid monoterpenoids,0.0,MS1_match,OJOKJVGGOVOIJJ-MRVPVSSYSA-N,"InChI=1S/C11H16O3/c1-7-4-11(13)9(6-10(7)12)5-8(2)14-3/h4,6,8,12-13H,5H2,1-3H3/t8-/m1/s1",CO[C@H](C)Cc1cc(O)c(C)cc1O,C11H16O3,pos_1_1proton2acetonitrile,196.109944372,OJOKJVGGOVOIJJ,Polyketides,Aromatic polyketides,Simple aromatic polyketides,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 8989,597,63,Terpenoids,Small peptides,Secoiridoid monoterpenoids,0.0,MS1_match,SSUUBVLXEIIFJB-TUHXDNEJSA-N,"InChI=1S/C24H35NO6/c1-12(26)31-19-18-21(2)7-6-17(27)23(18)15-9-13-8-14(15)22(29-4,10-16(13)28-3)24(19,30-5)20(23)25-11-21/h13-16,18-20,25H,6-11H2,1-5H3/t13-,14+,15-,16+,18-,19-,20+,21+,22-,23+,24-/m1/s1",CO[C@H]1C[C@@]2(OC)[C@H]3C[C@@H]1C[C@H]3[C@@]13C(=O)CC[C@@]4(C)CN[C@@H]1[C@]2(OC)[C@H](OC(C)=O)[C@H]43,C24H35NO6,pos_2_2proton3acetonitrile,433.24643784,SSUUBVLXEIIFJB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium peregrinum,885398.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium peregrinum'],6,0,6.0 8990,597,63,Terpenoids,Small peptides,Secoiridoid monoterpenoids,0.0,MS1_match,QUIBNSQWVBDPPR-XYNMJFAMSA-N,"InChI=1S/C24H35NO6/c1-5-25-10-21(2)7-6-15(29-4)23-13-8-12-14(28-3)9-22(16(13)17(12)26)24(20(23)25,31-11-30-22)19(27)18(21)23/h12-18,20,26H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17+,18-,20+,21+,22-,23+,24-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@@]5(C[C@@H]6OC)OCO[C@]5(C(=O)[C@H]23)[C@@H]14,C24H35NO6,pos_2_2proton3acetonitrile,433.24643784,QUIBNSQWVBDPPR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium yunnanense,6131857.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium yunnanense'],6,0,6.0 8991,597,63,Terpenoids,Small peptides,Secoiridoid monoterpenoids,0.0,MS1_match,QUIBNSQWVBDPPR-XYNMJFAMSA-N,"InChI=1S/C24H35NO6/c1-5-25-10-21(2)7-6-15(29-4)23-13-8-12-14(28-3)9-22(16(13)17(12)26)24(20(23)25,31-11-30-22)19(27)18(21)23/h12-18,20,26H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17+,18-,20+,21+,22-,23+,24-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@@]5(C[C@@H]6OC)OCO[C@]5(C(=O)[C@H]23)[C@@H]14,C24H35NO6,pos_2_2proton3acetonitrile,433.24643784,QUIBNSQWVBDPPR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,0,6.0 8992,595,-1,,,,0.0,MS1_match,NIGGLAWRQQYJEM-ZVAWHEGMSA-N,"InChI=1S/C25H35NO8/c1-12(27)34-19-18-21(2)7-6-15(30-4)24(18)20(26-10-21)25(19)23(32-11-33-25)9-14(29-3)13-8-22(24,28)17(23)16(13)31-5/h10,13-20,28H,6-9,11H2,1-5H3/t13-,14+,15+,16+,17+,18-,19+,20+,21+,22+,23-,24-,25-/m1/s1",CO[C@H]1[C@@H]2C[C@]3(O)[C@H]1[C@@]1(C[C@@H]2OC)OCO[C@]12[C@H]1N=C[C@]4(C)CC[C@H](OC)[C@@]13[C@@H]4[C@@H]2OC(C)=O,C25H35NO8,pos_1_1proton1methanol,477.23626708,NIGGLAWRQQYJEM,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium barbeyi,591161.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium barbeyi'],6,0,6.0 8993,595,-1,,,,0.0,MS1_match,YIRIOYAORYKQRE-ZVAWHEGMSA-N,"InChI=1S/C25H35NO8/c1-12(27)34-19-18-21(2)7-6-15(30-4)24(18)20(26(3)10-21)25(19)23(32-11-33-25)9-14(28)13-8-22(24,29)17(23)16(13)31-5/h6-7,13-20,28-29H,8-11H2,1-5H3/t13-,14+,15+,16+,17+,18-,19+,20+,21+,22+,23-,24-,25-/m1/s1",CO[C@H]1[C@@H]2C[C@]3(O)[C@H]1[C@@]1(C[C@@H]2O)OCO[C@]12[C@H]1N(C)C[C@]4(C)C=C[C@H](OC)[C@@]13[C@@H]4[C@@H]2OC(C)=O,C25H35NO8,pos_1_1proton1methanol,477.23626708,YIRIOYAORYKQRE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium siwanense,5737859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium siwanense'],6,0,6.0 8994,591,51,Polyketides,Linear polyketides,Acetogenins,0.2965603,ISDB,HZGVWCMMEULBPB-MPRWPCGUSA-N,"InChI=1S/C37H64O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28-35(39)36(40)30-29-34(38)27-24-21-19-20-23-26-33-31-32(2)42-37(33)41/h14-15,18,22,31-32,35-36,39-40H,3-13,16-17,19-21,23-30H2,1-2H3/b15-14-,22-18-",CCCCCCCCCCCC/C=C\CC/C=C\CCC(O)C(O)CCC(=O)CCCCCCCC1=CC(C)OC1=O,C37H64O5,,588.475375148,HZGVWCMMEULBPB,Polyketides,Linear polyketides,Acetogenins,Annona jahnii,3868482.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona jahnii'],4,3,6.686241149902344 8995,590,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_sodium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 8996,590,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_sodium,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 8997,589,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.36100006,ISDB,XZHWXGQZQLTSGY-YPMLDQLKSA-N,"InChI=1S/C18H20O5/c1-10-12-8-16(21-3)17(22-4)9-15(12)23-18(10)11-5-6-14(20-2)13(19)7-11/h5-10,18-19H,1-4H3/t10-,18-/m0/s1",COc1ccc([C@H]2Oc3cc(OC)c(OC)cc3[C@@H]2C)cc1O,C18H20O5,,316.13107374,XZHWXGQZQLTSGY,Shikimates and Phenylpropanoids,Lignans,Neolignans,Pterocarpus santalinus,834137.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Dalbergieae'],['Pterocarpus'],['Pterocarpus santalinus'],4,3,6.944000244140625 8998,587,263,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Simple coumarins,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_1_1proton1ammonium,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,1,8.5 8999,587,263,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Simple coumarins,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_1_1proton1ammonium,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,1,8.5 9000,582,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.4150284,ISDB,WKQNRCYKYCKESD-UHFFFAOYSA-N,"InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)([O-])OCC[N+](C)(C)C,C26H48NO7P,,517.316839506,WKQNRCYKYCKESD,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,7.160113573074341 9001,582,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.4150284,ISDB,WKQNRCYKYCKESD-YVHLTTHBSA-N,"InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3/b7-6-,10-9-,13-12-/t25-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H48NO7P,,517.316839506,WKQNRCYKYCKESD,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,7.160113573074341 9002,576,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HKMDHBXRMZEVHY-UHFFFAOYSA-N,"InChI=1S/C16H26O8/c1-7-8-3-4-16(2,9(8)6-22-14(7)21)24-15-13(20)12(19)11(18)10(5-17)23-15/h7-13,15,17-20H,3-6H2,1-2H3",CC1C(=O)OCC2C1CCC2(C)OC1OC(CO)C(O)C(O)C1O,C16H26O8,pos_1_1proton1ammonium,346.1627677919999,HKMDHBXRMZEVHY,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9003,576,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,PLSSBWGEYMENGJ-XLIFQNPRSA-N,"InChI=1S/C16H26O8/c1-7-2-3-9-8(5-22-15(21)11(7)9)6-23-16-14(20)13(19)12(18)10(4-17)24-16/h7-14,16-20H,2-6H2,1H3/t7-,8+,9+,10+,11+,12+,13+,14-,16+/m0/s1",C[C@H]1CC[C@@H]2[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)COC(=O)[C@@H]21,C16H26O8,pos_1_1proton1ammonium,346.162767792,PLSSBWGEYMENGJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 9004,575,1436,Terpenoids,Octadecanoids,Other Octadecanoids,0.8006644,ISDB,ACHDMUPTZYZIGR-JPAZTHTMSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3+,8-6+,14-11+",CC/C=C/C/C=C/C=C/C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,3,8.702657699584961 9005,575,1436,Terpenoids,Octadecanoids,Other Octadecanoids,0.8006644,ISDB,ACHDMUPTZYZIGR-CUHSZNQNSA-N,"InChI=1S/C18H28O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3-,8-6-,14-11+",CC/C=C\C/C=C\C=C\C(=O)CCCCCCCC(=O)O,C18H28O3,,292.203844756,ACHDMUPTZYZIGR,Fatty acids,Octadecanoids,Other Octadecanoids,Isatis tinctoria,631500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Isatideae'],['Isatis'],['Isatis tinctoria'],4,3,8.702657699584961 9006,573,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.72033876,ISDB,OYHQOLUKZRVURQ-HZJYTTRNSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)O,C18H32O2,,280.240230264,OYHQOLUKZRVURQ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus paniculatus,561287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus paniculatus'],6,2,9.881355047225952 9007,573,89,Fatty acids,Fatty Acids and Conjugates,Hydroxy fatty acids,0.72033876,ISDB,OYHQOLUKZRVURQ-AVQMFFATSA-N,"InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6+,10-9+",CCCCC/C=C/C/C=C/CCCCCCCC(=O)O,C18H32O2,,280.240230264,OYHQOLUKZRVURQ,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,2,9.881355047225952 9008,572,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.4295133,ISDB,NJXYDZDDOCQODQ-FCAPPQLESA-N,"InChI=1S/C40H77NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,32-38,40,42-47H,3-18,21-31H2,1-2H3,(H,41,48)/b20-19-/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1",CCCCCCCCC/C=C\CCCC[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCC,C40H77NO9,,715.559833044,NJXYDZDDOCQODQ,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,3,7.218053221702576 9009,572,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.4295133,ISDB,NJXYDZDDOCQODQ-WSEQXECZSA-N,"InChI=1S/C40H77NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,32-38,40,42-47H,3-18,21-31H2,1-2H3,(H,41,48)/b20-19+/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1",CCCCCCCCC/C=C/CCCC[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCC,C40H77NO9,,715.559833044,NJXYDZDDOCQODQ,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Rhaponticum chinense,27810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Cardueae'],['Klaseopsis'],['Klaseopsis chinensis'],4,3,7.218053221702576 9010,572,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.4295133,ISDB,NJXYDZDDOCQODQ-WSEQXECZSA-N,"InChI=1S/C40H77NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,32-38,40,42-47H,3-18,21-31H2,1-2H3,(H,41,48)/b20-19+/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1",CCCCCCCCC/C=C/CCCC[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCC,C40H77NO9,,715.559833044,NJXYDZDDOCQODQ,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Sagina japonica,161892.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Sagineae'],['Sagina'],['Sagina japonica'],4,3,7.218053221702576 9011,571,-1,,,,0.0,MS1_match,HRJAUSFIYSBLLI-VODSTRMTSA-N,"InChI=1S/C35H40O10/c1-21(36)41-26-20-33(5,40)35-29(42-22(2)37)25(32(3,4)45-35)19-27(43-31(39)24-15-11-8-12-16-24)34(35,6)30(26)44-28(38)18-17-23-13-9-7-10-14-23/h7-18,25-27,29-30,40H,19-20H2,1-6H3/b18-17+/t25-,26+,27+,29-,30+,33+,34-,35+/m1/s1",CC(=O)O[C@H]1C[C@](C)(O)[C@]23OC(C)(C)[C@H](C[C@H](OC(=O)c4ccccc4)[C@]2(C)[C@H]1OC(=O)/C=C/c1ccccc1)[C@H]3OC(C)=O,C35H40O10,pos_1_sodium,620.26214748,HRJAUSFIYSBLLI,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus carnosus,514583.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus carnosus'],7,0,7.0 9012,571,-1,,,,0.0,MS1_match,RACYNKLBFZMILD-UHFFFAOYSA-N,"InChI=1S/C35H40O10/c1-22(36)41-21-34-28(43-29(38)17-16-24-12-8-6-9-13-24)18-26-19-35(34,45-32(26,3)4)33(5,40)20-27(42-23(2)37)30(34)44-31(39)25-14-10-7-11-15-25/h6-17,26-28,30,40H,18-21H2,1-5H3",CC(=O)OCC12C(OC(=O)C=Cc3ccccc3)CC3CC1(OC3(C)C)C(C)(O)CC(OC(C)=O)C2OC(=O)c1ccccc1,C35H40O10,pos_1_sodium,620.26214748,RACYNKLBFZMILD,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Euonymus nanoides,5513354.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus nanoides'],7,0,7.0 9013,562,-1,,,,0.37917238,ISDB,OBWHQJYOOCRPST-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-14(19)13(18)11-6-5-10(17)7-12(11)20-15/h1-7,16-17,19H",O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)ccc12,C15H10O5,,270.05282342,OBWHQJYOOCRPST,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,9.516689538955688 9014,560,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.888796,ISDB,MBMFVVJRZMJLSK-AESNYCIYSA-N,"InChI=1S/C30H26O13/c31-16-5-3-15(4-6-16)22-12-21(35)26-20(34)10-17(11-23(26)42-22)41-30-29(39)28(38)27(37)24(43-30)13-40-25(36)8-2-14-1-7-18(32)19(33)9-14/h1-12,24,27-34,37-39H,13H2/b8-2+/t24-,27-,28+,29-,30-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O13,,594.137340892,MBMFVVJRZMJLSK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Perilla frutescens var. crispa,443474.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Elsholtzieae'],['Perilla'],['Perilla frutescens'],4,3,9.05518388748169 9015,560,88,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.888796,ISDB,MBMFVVJRZMJLSK-AESNYCIYSA-N,"InChI=1S/C30H26O13/c31-16-5-3-15(4-6-16)22-12-21(35)26-20(34)10-17(11-23(26)42-22)41-30-29(39)28(38)27(37)24(43-30)13-40-25(36)8-2-14-1-7-18(32)19(33)9-14/h1-12,24,27-34,37-39H,13H2/b8-2+/t24-,27-,28+,29-,30-/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O13,,594.137340892,MBMFVVJRZMJLSK,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Perilla frutescens,295678.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Elsholtzieae'],['Perilla'],['Perilla frutescens'],4,3,9.05518388748169 9016,556,-1,,,,0.0,MS1_match,JYDSKJBPKMQERO-JTQLQIEISA-N,"InChI=1S/C13H19N3O2/c14-13(15)3-1-2-10-9-7-12(18)11(17)6-8(9)4-5-16-10/h6-7,10,16-18H,1-5H2,(H3,14,15)/t10-/m0/s1",N=C(N)CCC[C@@H]1NCCc2cc(O)c(O)cc21,C13H19N3O2,pos_1_1proton1isopropanol,249.147726848,JYDSKJBPKMQERO,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 9017,554,692,Shikimates and Phenylpropanoids,Pseudoalkaloids,Cinnamic acids and derivatives,0.0,MS1_match,JWXKYGKJJZXYFA-PDVHHVOWSA-N,"InChI=1S/C33H42N2O10/c1-16(36)35-21-9-7-6-8-18(21)28(38)44-15-30-11-10-23(42-4)32-20-12-19-22(41-3)13-31(39,24(20)25(19)45-17(2)37)33(40,29(32)34-14-30)27(43-5)26(30)32/h6-9,14,19-20,22-27,29,39-40H,10-13,15H2,1-5H3,(H,35,36)/t19-,20-,22+,23+,24-,25+,26-,27+,29+,30+,31-,32+,33-/m1/s1",CO[C@H]1C[C@@]2(O)[C@H]3[C@@H](OC(C)=O)[C@@H]1C[C@H]3[C@@]13[C@@H](OC)CC[C@@]4(COC(=O)c5ccccc5NC(C)=O)C=N[C@@H]1[C@]2(O)[C@@H](OC)[C@H]43,C33H42N2O10,pos_2_1proton1sodium,626.283945544,JWXKYGKJJZXYFA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,2,7.0 9018,554,692,Shikimates and Phenylpropanoids,Pseudoalkaloids,Cinnamic acids and derivatives,0.0,MS1_match,JWXKYGKJJZXYFA-PDVHHVOWSA-N,"InChI=1S/C33H42N2O10/c1-16(36)35-21-9-7-6-8-18(21)28(38)44-15-30-11-10-23(42-4)32-20-12-19-22(41-3)13-31(39,24(20)25(19)45-17(2)37)33(40,29(32)34-14-30)27(43-5)26(30)32/h6-9,14,19-20,22-27,29,39-40H,10-13,15H2,1-5H3,(H,35,36)/t19-,20-,22+,23+,24-,25+,26-,27+,29+,30+,31-,32+,33-/m1/s1",CO[C@H]1C[C@@]2(O)[C@H]3[C@@H](OC(C)=O)[C@@H]1C[C@H]3[C@@]13[C@@H](OC)CC[C@@]4(COC(=O)c5ccccc5NC(C)=O)C=N[C@@H]1[C@]2(O)[C@@H](OC)[C@H]43,C33H42N2O10,pos_2_1proton1sodium,626.283945544,JWXKYGKJJZXYFA,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,2,7.0 9019,553,948,Terpenoids,Sesquiterpenoids,Chamigrane sesquiterpenoids,0.63057375,ISDB,PNIQVCYAORGJMD-UHFFFAOYSA-N,"InChI=1S/C13H20O2/c1-10(2)6-5-9(14)12(4)13(10)8-7-11(13,3)15-12/h7-9,14H,5-6H2,1-4H3",CC1(C)CCC(O)C2(C)OC3(C)C=CC132,C13H20O2,,208.14632988,PNIQVCYAORGJMD,Terpenoids,Sesquiterpenoids,Chamigrane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.022294998168945 9020,551,-1,,,,0.38162264,ISDB,IHFRPKCRDFDADJ-FUJDEKNSSA-N,"InChI=1S/C18H26O2/c1-12-14(19)5-6-15-17(12,3)8-7-13-11-16(2,20)9-10-18(13,15)4/h5-6,13,15,20H,1,7-11H2,2-4H3/t13-,15-,16-,17+,18-/m0/s1",C=C1C(=O)C=C[C@@H]2[C@@]3(C)CC[C@](C)(O)C[C@@H]3CC[C@]12C,C18H26O2,,274.193280072,IHFRPKCRDFDADJ,Terpenoids,Diterpenoids,Erythroxylane diterpenoids,Ceriops tagal,163833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Rhizophoraceae'],['Unknown'],['Ceriops'],['Ceriops tagal'],4,0,5.526490569114685 9021,550,335,Terpenoids,Diterpenoids,Norkaurane diterpenoids,0.35625422,ISDB,XWOCMLGYYIIDPY-WLZXLALPSA-N,"InChI=1S/C18H26O4/c1-15-5-3-13(20)8-12(15)2-6-16-9-17(21,7-4-14(15)16)18(22,10-16)11-19/h3,5,12,14,19,21-22H,2,4,6-11H2,1H3/t12-,14+,15-,16+,17-,18+/m1/s1",C[C@@]12C=CC(=O)C[C@H]1CC[C@]13C[C@](O)(CO)[C@@](O)(CC[C@H]12)C3,C18H26O4,,306.183109312,XWOCMLGYYIIDPY,Terpenoids,Diterpenoids,Norkaurane diterpenoids,Diplospora fruticosa,3877492.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Coffeeae'],['Diplospora'],['Diplospora fruticosa'],4,3,6.9250168800354 9022,546,199,Shikimates and Phenylpropanoids,Lignans,Linear diarylheptanoids,0.5574341,ISDB,VZZQQZMZDJETCS-GUKRZAEASA-N,"InChI=1S/C20H20O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-4,6-9,11-13,21-22,24H,5,10H2,1H3/b9-4+,17-13-",COc1cc(CCC(=O)/C=C(O)/C=C/c2ccc(O)cc2)ccc1O,C20H20O5,,340.13107374,VZZQQZMZDJETCS,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Aframomum letestuanum,791472.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Aframomum'],['Aframomum letestuanum'],4,3,7.729736328125 9023,545,-1,,,,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1potassium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 9024,545,-1,,,,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1potassium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 9025,544,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YDDGKXBLOXEEMN-XAKUNQSDSA-N,"InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O,C22H18O12,pos_1_1proton1ammonium,474.0798260159999,YDDGKXBLOXEEMN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 9026,544,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,YDDGKXBLOXEEMN-XAKUNQSDSA-N,"InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20+",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O,C22H18O12,pos_1_1proton1ammonium,474.0798260159999,YDDGKXBLOXEEMN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Pulsatilla cernua,542352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Pulsatilla'],['Pulsatilla cernua'],7,3,8.5 9027,543,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_1_1potassium,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9028,543,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_1_1potassium,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9029,541,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,UFLHIIWVXFIJGU-ARJAWSKDSA-N,"InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3-",CC/C=C\CCO,C6H12O,pos_2MHNH3,100.088815004,UFLHIIWVXFIJGU,Fatty acids,Fatty acyls,Fatty alcohols,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 9030,538,396,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.0,MS1_match,YGSBJLPWANWGED-HYXYOFMCSA-N,"InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46+,47+,48-/m0/s1",C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O,C48H78O18,pos_3_3proton,942.5188156560004,YGSBJLPWANWGED,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],9,1,9.5 9031,535,584,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,UTNHBQHELZUVMJ-GFFQCQNISA-N,"InChI=1S/C19H34O8/c1-10-6-12(7-19(2,3)13(10)5-4-11(22)8-20)26-18-17(25)16(24)15(23)14(9-21)27-18/h4-5,10-18,20-25H,6-9H2,1-3H3/b5-4+/t10-,11-,12+,13+,14-,15-,16+,17-,18-/m1/s1",C[C@@H]1C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@H]1/C=C/[C@@H](O)CO,C19H34O8,pos_1_1sodium1acetonitrile,390.22536804799984,UTNHBQHELZUVMJ,Terpenoids,Apocarotenoids,Megastigmanes,Salacia chinensis,380833.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia chinensis'],6,1,6.5 9032,534,882,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.690043,ISDB,LDQHURFLDDRWGZ-UHFFFAOYSA-N,"InChI=1S/C11H14O/c1-8(2)10-6-5-9(3)7-11(10)12-4/h5-7H,1H2,2-4H3",C=C(C)c1ccc(C)cc1OC,C11H14O,,162.104465068,LDQHURFLDDRWGZ,Terpenoids,Monoterpenoids,,Arnica montana,942734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Madieae'],['Arnica'],['Arnica montana'],4,2,7.760171890258789 9033,534,882,Terpenoids,Monoterpenoids,Menthane monoterpenoids,0.690043,ISDB,LDQHURFLDDRWGZ-UHFFFAOYSA-N,"InChI=1S/C11H14O/c1-8(2)10-6-5-9(3)7-11(10)12-4/h5-7H,1H2,2-4H3",C=C(C)c1ccc(C)cc1OC,C11H14O,,162.104465068,LDQHURFLDDRWGZ,Terpenoids,Monoterpenoids,,Calea pilosa,7606941.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Neurolaeneae'],['Calea'],['Calea pilosa'],4,2,7.760171890258789 9034,532,-1,,,,0.806561,ISDB,OUYCCCASQSFEME-QMMMGPOBSA-N,"InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1",N[C@@H](Cc1ccc(O)cc1)C(=O)O,C9H11NO3,,181.073893212,OUYCCCASQSFEME,Amino acids and Peptides,Small peptides,Aminoacids,Coptis japonica,387829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis japonica'],6,0,9.22624397277832 9035,532,-1,,,,0.806561,ISDB,OUYCCCASQSFEME-QMMMGPOBSA-N,"InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1",N[C@@H](Cc1ccc(O)cc1)C(=O)O,C9H11NO3,,181.073893212,OUYCCCASQSFEME,Amino acids and Peptides,Small peptides,Aminoacids,Catha edulis,282743.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Catha'],['Catha edulis'],6,0,9.22624397277832 9036,531,-1,,,,0.0,MS1_match,IZJKNGKMGFLJCM-NICCLXCISA-N,"InChI=1S/C36H52O20/c1-7-15-17(9-23(45-3)46-4)19(31(43)47-5)12-50-33(15)56-36-29(42)27(40)30-22(53-36)14-49-24(54-30)10-18-16(8-2)34(51-13-20(18)32(44)48-6)55-35-28(41)26(39)25(38)21(11-37)52-35/h7-8,12-13,15-18,21-30,33-42H,1-2,9-11,14H2,3-6H3/t15-,16-,17+,18+,21-,22-,24-,25-,26+,27-,28-,29-,30-,33+,34+,35+,36+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1OC[C@H]2O[C@@H](O[C@@H]3OC=C(C(=O)OC)[C@@H](CC(OC)OC)[C@H]3C=C)[C@H](O)[C@@H](O)[C@@H]2O1,C36H52O20,pos_2_2sodium,804.3051940640003,IZJKNGKMGFLJCM,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,0,7.0 9037,528,536,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.0,MS1_match,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,pos_1_1proton,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,7.5 9038,528,536,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.0,MS1_match,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,pos_1_1proton,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,3,7.5 9039,527,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.40602916,ISDB,FSMNQWHKVQFXMJ-NRYKUPCLSA-N,"InChI=1S/C36H54O11/c1-31(30(44)45)15-19-18-7-8-21-33(3)11-10-23(46-29-26(41)24(39)25(40)27(47-29)28(42)43)34(4,17-37)20(33)9-12-36(21,6)35(18,5)14-13-32(19,2)22(38)16-31/h7,19-21,23-27,29,37,39-41H,8-17H2,1-6H3,(H,42,43)(H,44,45)/t19-,20+,21+,23-,24-,25-,26+,27-,29+,31-,32+,33-,34+,35+,36+/m0/s1",C[C@@]1(C(=O)O)CC(=O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1,C36H54O11,,662.366612548,FSMNQWHKVQFXMJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Trifolium repens,116218.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Trifolium'],['Trifolium repens'],0,3,3.1241166591644287 9040,524,-1,,,,0.0,MS1_match,OCNYGKNIVPVPPX-UHFFFAOYSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3",COC(=O)C=Cc1ccc(O)c(O)c1,C10H10O4,pos_1_1sodium1acetonitrile,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9041,524,-1,,,,0.0,MS1_match,QURCVMIEKCOAJU-UHFFFAOYSA-N,"InChI=1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)",COc1ccc(C=CC(=O)O)cc1O,C10H10O4,pos_1_1sodium1acetonitrile,194.0579088,QURCVMIEKCOAJU,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9042,524,-1,,,,0.0,MS1_match,KSEBMYQBYZTDHS-UHFFFAOYSA-N,"InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)",COc1cc(C=CC(=O)O)ccc1O,C10H10O4,pos_1_1sodium1acetonitrile,194.0579088,KSEBMYQBYZTDHS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9043,524,-1,,,,0.0,MS1_match,KSEBMYQBYZTDHS-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+",COc1cc(/C=C/C(=O)O)ccc1O,C10H10O4,pos_1_1sodium1acetonitrile,194.0579088,KSEBMYQBYZTDHS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 9044,522,612,Terpenoids,Triterpenoids,Cycloartane triterpenoids,0.32418653,ISDB,XJSRVKXLEZHOGP-XUJCYHNHSA-N,"InChI=1S/C40H60O11/c1-22(41)47-20-37(9)29-14-17-38(10)30(36(29,8)16-15-32(37)49-24(3)43)13-12-27-28-18-35(6,7)33(50-25(4)44)34(51-26(5)45)40(28,21-48-23(2)42)31(46)19-39(27,38)11/h12,28-34,46H,13-21H2,1-11H3/t28-,29+,30+,31+,32-,33-,34-,36-,37+,38+,39+,40-/m0/s1",CC(=O)OC[C@]1(C)[C@@H]2CC[C@]3(C)[C@H](CC=C4[C@@H]5CC(C)(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]5(COC(C)=O)[C@H](O)C[C@]43C)[C@@]2(C)CC[C@@H]1OC(C)=O,C40H60O11,,716.41356274,XJSRVKXLEZHOGP,Terpenoids,Triterpenoids,Oleanane triterpenoids,Napoleonaea imperialis,909433.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Lecythidaceae'],['Unknown'],['Napoleonaea'],['Napoleonaea imperialis'],4,2,6.296746134757996 9045,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Premna microphylla,503286.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Premna'],['Premna microphylla'],4,1,7.6339638233184814 9046,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-UHFFFAOYSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3",CCCCCC=CCC=CCCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Bauhinia,560314.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Bauhinia'],['Unknown'],4,1,7.6339638233184814 9047,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-RISUCRHXSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6+,10-9+/t20-/m1/s1",CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Bauhinia purpurea,560318.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Cercideae'],['Bauhinia'],['Bauhinia purpurea'],4,1,7.6339638233184814 9048,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Mirabilis himalaica,985176.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Nyctaginaceae'],['Unknown'],['Mirabilis'],['Mirabilis himalaica'],4,1,7.6339638233184814 9049,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Polyalthia longifolia,204189.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Miliuseae'],['Monoon'],['Monoon longifolium'],4,1,7.6339638233184814 9050,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-HZJYTTRNSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Pseudostellaria heterophylla,698777.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Caryophyllaceae'],['Alsineae'],['Pseudostellaria'],['Pseudostellaria heterophylla'],4,1,7.6339638233184814 9051,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Saururus chinensis,154036.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Saururaceae'],['Unknown'],['Saururus'],['Saururus chinensis'],4,1,7.6339638233184814 9052,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-HZJYTTRNSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Nelumbo nucifera,532288.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Proteales'],['Nelumbonaceae'],['Unknown'],['Nelumbo'],['Nelumbo nucifera'],4,1,7.6339638233184814 9053,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-HZJYTTRNSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Saposhnikovia divaricata,737496.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Saposhnikovia'],['Saposhnikovia divaricata'],4,1,7.6339638233184814 9054,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-RISUCRHXSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6+,10-9+/t20-/m1/s1",CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Bhesa paniculata,1079062.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Centroplacaceae'],['Unknown'],['Bhesa'],['Bhesa paniculata'],4,1,7.6339638233184814 9055,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Adenocaulon himalaicum,935632.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Mutisieae'],['Adenocaulon'],['Adenocaulon himalaicum'],4,1,7.6339638233184814 9056,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Hernandia ovigera,1072062.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia ovigera'],4,1,7.6339638233184814 9057,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Hernandia guianensis,373836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Hernandiaceae'],['Unknown'],['Hernandia'],['Hernandia guianensis'],4,1,7.6339638233184814 9058,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Vitex agnus-castus,988127.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Vitex'],['Vitex agnus-castus'],4,1,7.6339638233184814 9059,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-IHNKIBRCSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6+,10-9-/t20-/m1/s1",CCCCC/C=C/C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.277009696,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Hyoscyamus niger,822716.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Hyoscyameae'],['Hyoscyamus'],['Hyoscyamus niger'],4,1,7.6339638233184814 9060,521,727,Fatty acids,Fatty acyls,Fatty aldehydes,0.78349096,ISDB,WECGLUPZRHILCT-KKFOGOCZSA-N,"InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](O)CO,C21H38O4,,354.27700969599994,WECGLUPZRHILCT,Fatty acids,Glycerolipids,Monoacylglycerols,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,1,7.6339638233184814 9061,520,799,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1ammonium,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,7.5 9062,520,799,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1ammonium,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,3,7.5 9063,520,799,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1ammonium,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Delphinium schmalhausenii,7591251.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium schmalhausenii'],6,3,7.5 9064,520,799,Fatty acids,Fatty esters,Wax monoesters,0.0,MS1_match,RBKMRGOHCLRTLZ-KHPPLWFESA-N,"InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10-",CCCCCCCC/C=C\CCCCCCCCCC(=O)OC,C21H40O2,pos_1_1proton1ammonium,324.30283052,RBKMRGOHCLRTLZ,Fatty acids,Fatty esters,Wax monoesters,Delphinium fissum,833960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium fissum'],6,3,7.5 9065,518,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.4020952,ISDB,MAIRBOUIUZTTQK-UHFFFAOYSA-N,"InChI=1S/C39H62O5/c1-4-6-8-10-12-14-16-18-20-22-24-26-31-28-32(40)29-34(41)37(31)38-33(39(43)36(44-3)30-35(38)42)27-25-23-21-19-17-15-13-11-9-7-5-2/h28-30,40-41H,4-27H2,1-3H3",CCCCCCCCCCCCCC1=C(c2c(O)cc(O)cc2CCCCCCCCCCCCC)C(=O)C=C(OC)C1=O,C39H62O5,,610.459725084,MAIRBOUIUZTTQK,Polyketides,Aromatic polyketides,Catechols with side chains,Ardisia brevicaulis,223967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia brevicaulis'],4,1,6.1083807945251465 9066,517,270,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,0.0,MS1_match,YQVMBBVXIUERPW-NSOVKSMOSA-N,"InChI=1S/C38H42N2O8/c1-39-13-11-21-16-29(41)30(44-3)18-24(21)27(39)15-20-7-9-22(10-8-20)48-36-26-17-28-32-23(12-14-40(28)2)34(42)38(47-6)37(46-5)33(32)25(26)19-31(45-4)35(36)43/h7-10,16,18-19,27-28,41-43H,11-15,17H2,1-6H3/t27-,28-/m0/s1",COc1cc2c(cc1O)CCN(C)[C@H]2Cc1ccc(Oc2c(O)c(OC)cc3c2C[C@H]2c4c(c(O)c(OC)c(OC)c4-3)CCN2C)cc1,C38H42N2O8,pos_2_1proton1potassium,654.294116304,YQVMBBVXIUERPW,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum faberi,6133309.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum faberi'],6,3,7.5 9067,514,-1,,,,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_sodium,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 9068,514,-1,,,,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_sodium,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,0,6.0 9069,514,-1,,,,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_sodium,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 9070,514,-1,,,,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_sodium,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 9071,514,-1,,,,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_sodium,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea japonica,988749.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea japonica'],6,0,6.0 9072,514,-1,,,,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_sodium,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea heracleifolia,988745.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea heracleifolia'],6,0,6.0 9073,514,-1,,,,0.0,MS1_match,TUODPMGCCJSJRH-LDYMZIIASA-N,"InChI=1S/C11H12O7/c12-7-3-1-6(2-4-7)5-11(18,10(16)17)8(13)9(14)15/h1-4,8,12-13,18H,5H2,(H,14,15)(H,16,17)/t8-,11-/m1/s1",O=C(O)[C@@H](O)[C@](O)(Cc1ccc(O)cc1)C(=O)O,C11H12O7,pos_1_sodium,256.05830272400004,TUODPMGCCJSJRH,Shikimates and Phenylpropanoids,,,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 9074,513,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.25672233,ISDB,WAHUIEHYVBLIER-GOSISDBHSA-N,"InChI=1S/C20H24O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-3,6-8,11-12,18,21,23-24H,4-5,9-10,13H2,1H3/t18-/m1/s1",COc1cc(CC[C@@H](O)CC(=O)CCc2ccc(O)cc2)ccc1O,C20H24O5,,344.162373868,WAHUIEHYVBLIER,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Curcuma comosa,1053721.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Curcuma'],['Curcuma comosa'],4,3,6.526889324188232 9075,513,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.25672233,ISDB,WAHUIEHYVBLIER-UHFFFAOYSA-N,"InChI=1S/C20H24O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-3,6-8,11-12,18,21,23-24H,4-5,9-10,13H2,1H3",COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O,C20H24O5,,344.1623738679999,WAHUIEHYVBLIER,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Juglans mandshurica,70093.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Juglans'],['Juglans mandshurica'],4,3,6.526889324188232 9076,513,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.25672233,ISDB,WAHUIEHYVBLIER-SFHVURJKSA-N,"InChI=1S/C20H24O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-3,6-8,11-12,18,21,23-24H,4-5,9-10,13H2,1H3/t18-/m0/s1",COc1cc(CC[C@H](O)CC(=O)CCc2ccc(O)cc2)ccc1O,C20H24O5,,344.162373868,WAHUIEHYVBLIER,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Alpinia officinarum,477388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Alpinia'],['Alpinia officinarum'],4,3,6.526889324188232 9077,513,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.25672233,ISDB,WAHUIEHYVBLIER-GOSISDBHSA-N,"InChI=1S/C20H24O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-3,6-8,11-12,18,21,23-24H,4-5,9-10,13H2,1H3/t18-/m1/s1",COc1cc(CC[C@@H](O)CC(=O)CCc2ccc(O)cc2)ccc1O,C20H24O5,,344.162373868,WAHUIEHYVBLIER,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Juglans regia,138717.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Juglans'],['Juglans regia'],4,3,6.526889324188232 9078,513,200,Alkaloids,Diarylheptanoids,Linear diarylheptanoids,0.25672233,ISDB,WAHUIEHYVBLIER-GOSISDBHSA-N,"InChI=1S/C20H24O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-3,6-8,11-12,18,21,23-24H,4-5,9-10,13H2,1H3/t18-/m1/s1",COc1cc(CC[C@@H](O)CC(=O)CCc2ccc(O)cc2)ccc1O,C20H24O5,,344.162373868,WAHUIEHYVBLIER,Shikimates and Phenylpropanoids,Diarylheptanoids,Linear diarylheptanoids,Engelhardia roxburghiana,722586.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Juglandaceae'],['Unknown'],['Engelhardia'],['Engelhardia roxburghiana'],4,3,6.526889324188232 9079,511,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.32771954,ISDB,BMQNSHDVIYZULR-FZJJXLMSSA-N,"InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-26,36,41H,27-29H2,1-10H3/b12-11+,18-13-,19-14-,25-23+,26-24+,30-16+,31-17+,32-20-,33-21-",CC1=C(/C=C/C(C)=C\C=C/C(C)=C/C=C/C=C(C)/C=C\C=C(C)/C=C/C2=C(C)CC(O)CC2(C)C)C(C)(C)CC=C1,C40H54O,,550.417466348,BMQNSHDVIYZULR,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],4,3,6.810878157615662 9080,508,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.83430046,ISDB,,,,,,,UDATXGSDHZXTEH,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,3.3372018337249756 9081,503,-1,,,,0.0,MS1_match,HJOAQEYWNOPRHE-LCENJUANSA-N,"InChI=1S/C27H34O15/c1-10-4-13(29)18-14(30)5-15-12(25(18)40-10)3-2-11(7-37-15)8-38-26-24(36)22(34)20(32)17(42-26)9-39-27-23(35)21(33)19(31)16(6-28)41-27/h2,4-5,16-17,19-24,26-28,30-36H,3,6-9H2,1H3/t16-,17-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)CC=C(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O15,pos_1_1proton,598.189770388,HJOAQEYWNOPRHE,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 9082,503,-1,,,,0.0,MS1_match,HJOAQEYWNOPRHE-LCENJUANSA-N,"InChI=1S/C27H34O15/c1-10-4-13(29)18-14(30)5-15-12(25(18)40-10)3-2-11(7-37-15)8-38-26-24(36)22(34)20(32)17(42-26)9-39-27-23(35)21(33)19(31)16(6-28)41-27/h2,4-5,16-17,19-24,26-28,30-36H,3,6-9H2,1H3/t16-,17-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)CC=C(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)CO3,C27H34O15,pos_1_1proton,598.189770388,HJOAQEYWNOPRHE,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 9083,502,-1,,,,0.0,MS1_match,HCZAFKIGYZFVCO-SYBTYGMXSA-N,"InChI=1S/C35H54O14/c1-15-30(49-32-28(42)26(40)25(39)22(13-36)48-32)27(41)29(43)31(46-15)47-18-11-17-4-5-21-20(34(17,3)23(37)12-18)6-8-33(2)19(7-9-35(21,33)44)16-10-24(38)45-14-16/h10,15,17-23,25-32,36-37,39-44H,4-9,11-14H2,1-3H3/t15-,17+,18+,19+,20-,21+,22+,23+,25+,26-,27-,28+,29+,30-,31-,32-,33+,34-,35-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2C[C@H]3CC[C@@H]4[C@H](CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]45O)[C@@]3(C)[C@H](O)C2)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C35H54O14,pos_2_2sodium,698.351356408,HCZAFKIGYZFVCO,Terpenoids,Steroids,Cardenolides,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 9084,502,-1,,,,0.0,MS1_match,DPHZHOXPZJMWTP-NDAFQYKHSA-N,"InChI=1S/C35H54O14/c1-15-25(39)28(42)30(49-31-29(43)27(41)26(40)22(13-36)48-31)32(46-15)47-18-11-17-4-5-21-20(34(17,3)23(37)12-18)6-8-33(2)19(7-9-35(21,33)44)16-10-24(38)45-14-16/h10,15,17-23,25-32,36-37,39-44H,4-9,11-14H2,1-3H3/t15-,17+,18+,19+,20-,21+,22+,23+,25-,26+,27-,28+,29+,30+,31-,32-,33+,34-,35-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2C[C@H]3CC[C@@H]4[C@H](CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]45O)[C@@]3(C)[C@H](O)C2)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C35H54O14,pos_2_2sodium,698.351356408,DPHZHOXPZJMWTP,Terpenoids,Steroids,Cardenolides,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,0,7.0 9085,502,-1,,,,0.0,MS1_match,DPHZHOXPZJMWTP-NDAFQYKHSA-N,"InChI=1S/C35H54O14/c1-15-25(39)28(42)30(49-31-29(43)27(41)26(40)22(13-36)48-31)32(46-15)47-18-11-17-4-5-21-20(34(17,3)23(37)12-18)6-8-33(2)19(7-9-35(21,33)44)16-10-24(38)45-14-16/h10,15,17-23,25-32,36-37,39-44H,4-9,11-14H2,1-3H3/t15-,17+,18+,19+,20-,21+,22+,23+,25-,26+,27-,28+,29+,30+,31-,32-,33+,34-,35-/m0/s1",C[C@@H]1O[C@@H](O[C@@H]2C[C@H]3CC[C@@H]4[C@H](CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]45O)[C@@]3(C)[C@H](O)C2)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C35H54O14,pos_2_2sodium,698.351356408,DPHZHOXPZJMWTP,Terpenoids,Steroids,Cardenolides,Euonymus hamiltonianus,174310.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus hamiltonianus'],7,0,7.0 9086,500,-1,,,,0.7186629,ISDB,NSXJYXNANXQGCY-JOXVHFRWSA-N,"InChI=1S/C34H40O10/c1-16(2)10-11-20-25(36)23-26(37)21-14-19(35)15-22-32(7,8)44-33(30(40)41-9,13-12-17(3)29(38)39)34(21,22)43-28(23)24-27(20)42-18(4)31(24,5)6/h10,12,14,18,22,36H,11,13,15H2,1-9H3,(H,38,39)/b17-12+/t18-,22+,33+,34-/m0/s1",COC(=O)[C@@]1(C/C=C(\C)C(=O)O)OC(C)(C)[C@H]2CC(=O)C=C3C(=O)c4c(O)c(CC=C(C)C)c5c(c4O[C@@]321)C(C)(C)[C@H](C)O5,C34H40O10,,608.26214748,NSXJYXNANXQGCY,Polyketides,,,Garcinia acuminata,311081.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia acuminata'],4,0,6.874651670455933 9087,500,-1,,,,0.7186629,ISDB,NSXJYXNANXQGCY-JOXVHFRWSA-N,"InChI=1S/C34H40O10/c1-16(2)10-11-20-25(36)23-26(37)21-14-19(35)15-22-32(7,8)44-33(30(40)41-9,13-12-17(3)29(38)39)34(21,22)43-28(23)24-27(20)42-18(4)31(24,5)6/h10,12,14,18,22,36H,11,13,15H2,1-9H3,(H,38,39)/b17-12+/t18-,22+,33+,34-/m0/s1",COC(=O)[C@@]1(C/C=C(\C)C(=O)O)OC(C)(C)[C@H]2CC(=O)C=C3C(=O)c4c(O)c(CC=C(C)C)c5c(c4O[C@@]321)C(C)(C)[C@H](C)O5,C34H40O10,,608.26214748,NSXJYXNANXQGCY,Polyketides,,,Garcinia scortechinii,149780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia scortechinii'],4,0,6.874651670455933 9088,500,-1,,,,0.7186629,ISDB,NSXJYXNANXQGCY-JOXVHFRWSA-N,"InChI=1S/C34H40O10/c1-16(2)10-11-20-25(36)23-26(37)21-14-19(35)15-22-32(7,8)44-33(30(40)41-9,13-12-17(3)29(38)39)34(21,22)43-28(23)24-27(20)42-18(4)31(24,5)6/h10,12,14,18,22,36H,11,13,15H2,1-9H3,(H,38,39)/b17-12+/t18-,22+,33+,34-/m0/s1",COC(=O)[C@@]1(C/C=C(\C)C(=O)O)OC(C)(C)[C@H]2CC(=O)C=C3C(=O)c4c(O)c(CC=C(C)C)c5c(c4O[C@@]321)C(C)(C)[C@H](C)O5,C34H40O10,,608.26214748,NSXJYXNANXQGCY,Polyketides,,,Garcinia elliptica,6099695.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia elliptica'],4,0,6.874651670455933 9089,499,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.27951214,ISDB,JRHJXXLCNATYLS-NGZWBNMCSA-N,"InChI=1S/C40H56O3/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)25-38(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36-24-37-39(8,9)26-34(42)27-40(37,10)43-36/h11-24,33-36,41-42H,25-27H2,1-10H3/b12-11+,17-13+,19-14+,22-21+,28-15+,29-16+,30-18+,31-20+/t33-,34-,35-,36+,40+/m0/s1",CC1=C[C@H](O)CC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)[C@H]1C=C2C(C)(C)C[C@H](O)C[C@@]2(C)O1,C40H56O3,,584.422945652,JRHJXXLCNATYLS,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-ε)",Ranunculus acris,387818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus acris'],6,2,8.118048548698425 9090,497,564,Fatty acids,Octadecanoids,Jasmonic acids,0.27896562,ISDB,OOYCGMQJIWHWHA-FZHXTVGLSA-N,"InChI=1S/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-12,14H,3,6-9H2,1-2H3/b5-4-/t10-,11-,12-/m0/s1",CC/C=C\C[C@H]1[C@H](CC(=O)OC)CC[C@@H]1O,C13H22O3,,226.156894564,OOYCGMQJIWHWHA,Fatty acids,Octadecanoids,Jasmonic acids,Boronia megastigma,3942546.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Boronia'],['Boronia megastigma'],4,3,6.615862488746643 9091,495,676,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,0.0,MS1_match,HGQDVTBUGONPNS-XIKSMUEASA-N,"InChI=1S/C20H24O12/c1-9-6-14(7-16(25)27-9)31-20-19(30-13(5)24)18(29-12(4)23)17(28-11(3)22)15(32-20)8-26-10(2)21/h6-7,15,17-20H,8H2,1-5H3/t15-,17-,18+,19-,20-/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2cc(C)oc(=O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C20H24O12,pos_1_1proton1ammonium,456.126776208,HGQDVTBUGONPNS,,,,Delphinium gracile,209872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium gracile'],6,0,6.0 9092,494,-1,,,,0.0,MS1_match,FSJKQGGXOQBDIY-IBGZPJMESA-N,"InChI=1S/C29H33NO7/c1-30-10-9-17-12-24(35-5)29(37-21-14-23(34-4)22(33-3)13-18(21)15-31)27-25(17)19(30)11-16-7-8-20(32-2)28(36-6)26(16)27/h7-8,12-14,19,31H,9-11,15H2,1-6H3/t19-/m0/s1",COc1cc(CO)c(Oc2c(OC)cc3c4c2-c2c(ccc(OC)c2OC)C[C@@H]4N(C)CC3)cc1OC,C29H33NO7,pos_3_3proton,507.225702396,FSJKQGGXOQBDIY,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum tuberiferum,338809.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum tuberiferum'],6,0,6.0 9093,493,-1,,,,0.320599,ISDB,JSLPGGGPWKHMKK-IWSPIJDZSA-N,"InChI=1S/C10H14O4/c1-13-9-2-6(4-11)8-5-14-10(12)3-7(8)9/h2,7-9,11H,3-5H2,1H3/t7-,8-,9-/m1/s1",CO[C@@H]1C=C(CO)[C@H]2COC(=O)C[C@H]21,C10H14O4,,198.089208928,JSLPGGGPWKHMKK,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Scrophularia buergeriana,764427.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Scrophulariaceae'],['Scrophularieae'],['Scrophularia'],['Scrophularia buergeriana'],4,0,5.282395958900452 9094,489,-1,,,,0.3027598,ISDB,MWQCBVWCBTUPDQ-HZJYTTRNSA-N,"InChI=1S/C22H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,24H,2-5,8,11-21H2,1H3,(H,23,25)/b7-6-,10-9-",CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)NCCO,C22H41NO2,,351.313729552,MWQCBVWCBTUPDQ,Fatty acids,Fatty amides,N-acyl ethanolamines (endocannabinoids),Trypanosoma brucei,494245.0,['Eukaryota'],['Unknown'],['Unknown'],['Unknown'],['Kinetoplastea'],['Unknown'],['Unknown'],['Trypanosoma'],['Trypanosoma brucei'],1,0,2.211039185523987 9095,487,-1,,,,0.0,MS1_match,XOWVMKHUWDJUHZ-CHHYLKMXSA-N,"InChI=1S/C27H34O13/c1-12-17(38-20(30)7-5-13-4-6-16(29)18(8-13)35-2)9-14-15(25(34)36-3)11-37-26(21(12)14)40-27-24(33)23(32)22(31)19(10-28)39-27/h4-8,11-12,14,17,19,21-24,26-29,31-33H,9-10H2,1-3H3/b7-5-/t12-,14+,17-,19+,21+,22+,23-,24+,26-,27-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](OC(=O)/C=C\c3ccc(O)c(OC)c3)C[C@H]12,C27H34O13,pos_2_1proton1sodium,566.199941148,XOWVMKHUWDJUHZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 9096,487,-1,,,,0.0,MS1_match,XOWVMKHUWDJUHZ-CHHYLKMXSA-N,"InChI=1S/C27H34O13/c1-12-17(38-20(30)7-5-13-4-6-16(29)18(8-13)35-2)9-14-15(25(34)36-3)11-37-26(21(12)14)40-27-24(33)23(32)22(31)19(10-28)39-27/h4-8,11-12,14,17,19,21-24,26-29,31-33H,9-10H2,1-3H3/b7-5-/t12-,14+,17-,19+,21+,22+,23-,24+,26-,27-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](OC(=O)/C=C\c3ccc(O)c(OC)c3)C[C@H]12,C27H34O13,pos_2_1proton1sodium,566.199941148,XOWVMKHUWDJUHZ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera insularis,5746388.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera insularis'],7,0,7.0 9097,485,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.26170954,ISDB,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium regelii,483028.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium regelii'],6,3,8.546838164329529 9098,485,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.26170954,ISDB,JJRYPZMXNLLZFH-URWSZGRFSA-N,"InChI=1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3/b6-5+/t13-/m1/s1",CC(=O)/C=C/[C@@]1(O)C(C)=CC(=O)CC1(C)C,C13H18O3,,222.125594436,JJRYPZMXNLLZFH,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Tripterygium wilfordii,300831.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Tripterygium'],['Tripterygium wilfordii'],6,3,8.546838164329529 9099,484,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.507152,ISDB,DKCTUWGBNPXOKV-FNJLGOJISA-N,"InChI=1S/C52H80O15/c1-30-24-41(65-52(27-30)43(55)13-12-37(64-52)28-49(7,58)48(57)60-29-31(2)25-42-38(53)17-23-59-42)32(3)10-11-36-15-20-51(63-36)21-16-40-47(67-51)44(56)35(6)46(62-40)39(54)26-34(5)45-33(4)14-19-50(66-45)18-8-9-22-61-50/h10-11,25,27,32-34,36-47,53-56,58H,6,8-9,12-24,26,28-29H2,1-5,7H3/b11-10+,31-25+/t32-,33-,34+,36+,37+,38-,39+,40-,41+,42+,43-,44-,45-,46+,47-,49-,50+,51-,52-/m1/s1",C=C1[C@@H](O)[C@@H]2O[C@]3(CC[C@H](/C=C/[C@@H](C)[C@@H]4CC(C)=C[C@@]5(O[C@H](C[C@@](C)(O)C(=O)OC/C(C)=C/[C@@H]6OCC[C@H]6O)CC[C@H]5O)O4)O3)CC[C@H]2O[C@@H]1[C@@H](O)C[C@H](C)[C@@H]1O[C@@]2(CCCCO2)CC[C@H]1C,C52H80O15,,944.54972186,DKCTUWGBNPXOKV,Polyketides,Polyethers,Polyether ionophores,Prorocentrum lima,5986377.0,['Eukaryota'],['Unknown'],['Ciliophora'],['Colpodea'],['Cyrtolophosidida'],['Unknown'],['Unknown'],['Aristerostoma'],['Prorocentrum lima'],1,1,3.5286080837249756 9100,484,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.507152,ISDB,DKCTUWGBNPXOKV-FNJLGOJISA-N,"InChI=1S/C52H80O15/c1-30-24-41(65-52(27-30)43(55)13-12-37(64-52)28-49(7,58)48(57)60-29-31(2)25-42-38(53)17-23-59-42)32(3)10-11-36-15-20-51(63-36)21-16-40-47(67-51)44(56)35(6)46(62-40)39(54)26-34(5)45-33(4)14-19-50(66-45)18-8-9-22-61-50/h10-11,25,27,32-34,36-47,53-56,58H,6,8-9,12-24,26,28-29H2,1-5,7H3/b11-10+,31-25+/t32-,33-,34+,36+,37+,38-,39+,40-,41+,42+,43-,44-,45-,46+,47-,49-,50+,51-,52-/m1/s1",C=C1[C@@H](O)[C@@H]2O[C@]3(CC[C@H](/C=C/[C@@H](C)[C@@H]4CC(C)=C[C@@]5(O[C@H](C[C@@](C)(O)C(=O)OC/C(C)=C/[C@@H]6OCC[C@H]6O)CC[C@H]5O)O4)O3)CC[C@H]2O[C@@H]1[C@@H](O)C[C@H](C)[C@@H]1O[C@@]2(CCCCO2)CC[C@H]1C,C52H80O15,,944.54972186,DKCTUWGBNPXOKV,Polyketides,Polyethers,Polyether ionophores,Conticribra weissflogii,932038.0,['Eukaryota'],['Unknown'],['Bacillariophyta'],['Mediophyceae'],['Unknown'],['Unknown'],['Unknown'],['Thalassiosira'],['Unknown'],1,1,3.5286080837249756 9101,483,756,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,0.46091127,ISDB,APGVHKPCMRXAPJ-UHFFFAOYSA-N,"InChI=1S/C39H60O5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27-38(40)43-29-23-26-35-31-36(41-5)39(37(32-35)42-6)44-30-28-34(4)25-22-24-33(2)3/h11-12,14-15,23-24,26,28,31-32H,7-10,13,16-22,25,27,29-30H2,1-6H3",CCCCCC=CCC=CCCCCCCCC(=O)OCC=Cc1cc(OC)c(OCC=C(C)CCC=C(C)C)c(OC)c1,C39H60O5,,608.44407502,APGVHKPCMRXAPJ,,,,Ligularia nelumbifolia,896803.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia nelumbifolia'],4,0,5.843645095825195 9102,480,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,QEYACURRVKYESS-UHFFFAOYSA-N,"InChI=1S/C21H24NO4/c1-22-11-10-16-17(13-19(24-3)21(26-5)20(16)25-4)18(22)12-14-6-8-15(23-2)9-7-14/h6-11,13H,12H2,1-5H3/q+1",COc1ccc(Cc2c3cc(OC)c(OC)c(OC)c3cc[n+]2C)cc1,C21H24NO4+,pos_1_1proton1acetonitrile,354.16998466809,QEYACURRVKYESS,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 9103,480,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,AZGCZIGARDCCNC-UHFFFAOYSA-N,"InChI=1S/C21H24NO4/c1-22-11-10-15-13-18(24-3)20(25-4)21(26-5)19(15)17(22)12-14-6-8-16(23-2)9-7-14/h6-11,13H,12H2,1-5H3/q+1",COc1ccc(Cc2c3c(=[O+]C)c(OC)c(OC)cc-3ccn2C)cc1,C21H24NO4+,pos_1_1proton1acetonitrile,354.1699846680899,AZGCZIGARDCCNC,Alkaloids,Histidine alkaloids,,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 9104,480,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,KKZYXZUXNZXFFZ-HNNXBMFYSA-N,"InChI=1S/C21H24NO4/c1-22(2)6-5-12-8-18(23-3)21(24-4)20-14-10-17-16(25-11-26-17)9-13(14)7-15(22)19(12)20/h8-10,15H,5-7,11H2,1-4H3/q+1/t15-/m0/s1",COc1cc2c3c(c1OC)-c1cc4c(cc1C[C@@H]3[N+](C)(C)CC2)OCO4,C21H24NO4+,pos_1_1proton1acetonitrile,354.16998466809,KKZYXZUXNZXFFZ,Alkaloids,Tyrosine alkaloids,Aporphine alkaloids,Thalictrum przewalskii,782787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum przewalskii'],6,0,6.0 9105,480,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,IPABSWBNWMXCHM-LBOXEOMUSA-N,"InChI=1S/C21H24NO4/c1-22-7-6-14-9-19-20(26-12-25-19)10-15(14)17(22)8-13-4-5-18(23-2)21(24-3)16(13)11-22/h4-5,9-10,17H,6-8,11-12H2,1-3H3/q+1/t17-,22?/m0/s1",COc1ccc2c(c1OC)C[N+]1(C)CCc3cc4c(cc3[C@@H]1C2)OCO4,C21H24NO4+,pos_1_1proton1acetonitrile,354.16998466809,IPABSWBNWMXCHM,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 9106,480,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,IPABSWBNWMXCHM-LBOXEOMUSA-N,"InChI=1S/C21H24NO4/c1-22-7-6-14-9-19-20(26-12-25-19)10-15(14)17(22)8-13-4-5-18(23-2)21(24-3)16(13)11-22/h4-5,9-10,17H,6-8,11-12H2,1-3H3/q+1/t17-,22?/m0/s1",COc1ccc2c(c1OC)C[N+]1(C)CCc3cc4c(cc3[C@@H]1C2)OCO4,C21H24NO4+,pos_1_1proton1acetonitrile,354.16998466809,IPABSWBNWMXCHM,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,0,6.0 9107,479,583,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.34984076,ISDB,OJSSGTSWSGCVLV-UHFFFAOYSA-N,"InChI=1S/C20H18N2O2/c1-24-20(23)11-16-15-7-3-5-9-18(15)22-19(16)10-13-12-21-17-8-4-2-6-14(13)17/h2-9,12,21-22H,10-11H2,1H3",COC(=O)Cc1c(Cc2c[nH]c3ccccc23)[nH]c2ccccc12,C20H18N2O2,,318.136827816,OJSSGTSWSGCVLV,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,Fusarium,655794.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Hypocreales'],['Nectriaceae'],['Unknown'],['Fusarium'],['Unknown'],1,3,3.8993630409240723 9108,474,476,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_2MH,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 9109,473,1070,Terpenoids,Meroterpenoids,Merohemiterpenoids,0.27484983,ISDB,DHWMEIUMQKRKAS-XJKSGUPXSA-N,"InChI=1S/C18H22O6/c1-8(19)10-12(20)9-6-7-17(2,3)23-14(9)11-13(21)16(22)18(4,5)24-15(10)11/h6-7,13,16,20-22H,1-5H3/t13-,16+/m0/s1",CC(=O)c1c(O)c2c(c3c1OC(C)(C)[C@H](O)[C@H]3O)OC(C)(C)C=C2,C18H22O6,,334.141638424,DHWMEIUMQKRKAS,Terpenoids,Meroterpenoids,Merohemiterpenoids,Melicope erromangensis,6125470.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Melicope'],['Melicope erromangensis'],4,3,6.5993993282318115 9110,471,391,Alkaloids,Ornithine alkaloids,Polyamines,0.59305346,ISDB,UBMDAKWARMURDL-FNORWQNLSA-N,"InChI=1S/C15H22N4O3/c1-22-13-10-11(4-6-12(13)20)5-7-14(21)18-8-2-3-9-19-15(16)17/h4-7,10,20H,2-3,8-9H2,1H3,(H,18,21)(H4,16,17,19)/b7-5+",COc1cc(/C=C/C(=O)NCCCCNC(=N)N)ccc1O,C15H22N4O3,,306.169190564,UBMDAKWARMURDL,Alkaloids,Ornithine alkaloids,Polyamines,Corydalis saxicola,345836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Papaveraceae'],['Unknown'],['Corydalis'],['Corydalis saxicola'],5,3,8.87221384048462 9111,465,1417,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.59115016,ISDB,RJLAJQDKXWWUNG-UHFFFAOYSA-N,"InChI=1S/C13H18O/c1-8-4-5-9(2)12-11(8)7-6-10(3)13(12)14/h4-5,10,13-14H,6-7H2,1-3H3",Cc1ccc(C)c2c1CCC(C)C2O,C13H18O,,190.135765196,RJLAJQDKXWWUNG,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,7.864600658416748 9112,464,427,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.0,MS1_match,BDLLSHRIFPDGQB-AATRIKPKSA-N,"InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-6H,2-4,7-17H2,1H3,(H,19,20)/b6-5+",CCCC/C=C/CCCCCCCCCCCC(=O)O,C18H34O2,pos_1_1proton1acetonitrile,282.255880328,BDLLSHRIFPDGQB,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9113,463,69,Terpenoids,Sesquiterpenoids,Furans,0.51607275,ISDB,QANDVVHKFKLLCQ-XRYUJSLGSA-N,"InChI=1S/C21H34O4/c1-17(2)8-7-9-19(4)14(17)12-15-20(5,24-15)21(19)11-10-18(3,25-21)13-16(22)23-6/h14-15H,7-13H2,1-6H3/t14-,15-,18-,19-,20-,21-/m0/s1",COC(=O)C[C@]1(C)CC[C@]2(O1)[C@@]1(C)CCCC(C)(C)[C@@H]1C[C@@H]1O[C@@]12C,C21H34O4,,350.245709568,QANDVVHKFKLLCQ,Terpenoids,Diterpenoids,Secolabdane diterpenoids,Grindelia camporum,974633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia camporum'],4,1,6.564291000366211 9114,463,69,Terpenoids,Sesquiterpenoids,Furans,0.51607275,ISDB,QANDVVHKFKLLCQ-XRYUJSLGSA-N,"InChI=1S/C21H34O4/c1-17(2)8-7-9-19(4)14(17)12-15-20(5,24-15)21(19)11-10-18(3,25-21)13-16(22)23-6/h14-15H,7-13H2,1-6H3/t14-,15-,18-,19-,20-,21-/m0/s1",COC(=O)C[C@]1(C)CC[C@]2(O1)[C@@]1(C)CCCC(C)(C)[C@@H]1C[C@@H]1O[C@@]12C,C21H34O4,,350.245709568,QANDVVHKFKLLCQ,Terpenoids,Diterpenoids,Secolabdane diterpenoids,Grindelia stricta,981039.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia stricta'],4,1,6.564291000366211 9115,463,69,Terpenoids,Sesquiterpenoids,Furans,0.51607275,ISDB,QANDVVHKFKLLCQ-GLWNWQENSA-N,"InChI=1S/C21H34O4/c1-17(2)8-7-9-19(4)14(17)12-15-20(5,24-15)21(19)11-10-18(3,25-21)13-16(22)23-6/h14-15H,7-13H2,1-6H3/t14-,15+,18-,19+,20+,21+/m1/s1",COC(=O)C[C@@]1(C)CC[C@]2(O1)[C@@]1(C)CCCC(C)(C)[C@H]1C[C@@H]1O[C@@]12C,C21H34O4,,350.245709568,QANDVVHKFKLLCQ,Terpenoids,Diterpenoids,Secolabdane diterpenoids,Grindelia squarrosa,912596.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia squarrosa'],4,1,6.564291000366211 9116,463,69,Terpenoids,Sesquiterpenoids,Furans,0.51607275,ISDB,QANDVVHKFKLLCQ-XRYUJSLGSA-N,"InChI=1S/C21H34O4/c1-17(2)8-7-9-19(4)14(17)12-15-20(5,24-15)21(19)11-10-18(3,25-21)13-16(22)23-6/h14-15H,7-13H2,1-6H3/t14-,15-,18-,19-,20-,21-/m0/s1",COC(=O)C[C@]1(C)CC[C@]2(O1)[C@@]1(C)CCCC(C)(C)[C@@H]1C[C@@H]1O[C@@]12C,C21H34O4,,350.245709568,QANDVVHKFKLLCQ,Terpenoids,Diterpenoids,Secolabdane diterpenoids,Grindelia hirsutula,278958.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Grindelia'],['Grindelia hirsutula'],4,1,6.564291000366211 9117,460,-1,,,,0.0,MS1_match,GSLQFCAUUPKMEV-UHFFFAOYSA-N,"InChI=1S/C10H14O4/c1-7-2-3-8(9(13)4-7)10(14,5-11)6-12/h2-4,11-14H,5-6H2,1H3",Cc1ccc(C(O)(CO)CO)c(O)c1,C10H14O4,pos_1_1proton1methanol,198.089208928,GSLQFCAUUPKMEV,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 9118,455,98,Polyketides,Chromanes,Chromones,0.696574,ISDB,OIQRCBINTJVAGZ-HNNXBMFYSA-N,"InChI=1S/C15H14O8/c1-15(20)4-9-6(5-22-15)12(16)10-7(23-9)3-8(21-2)13(17)11(10)14(18)19/h3,17,20H,4-5H2,1-2H3,(H,18,19)/t15-/m0/s1",COc1cc2oc3c(c(=O)c2c(C(=O)O)c1O)CO[C@](C)(O)C3,C15H14O8,,322.068867408,OIQRCBINTJVAGZ,Polyketides,Chromanes,Chromones,Penicillium dodgei,5310733.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium dodgei'],1,3,5.2862958908081055 9119,455,98,Polyketides,Chromanes,Chromones,0.696574,ISDB,OIQRCBINTJVAGZ-HNNXBMFYSA-N,"InChI=1S/C15H14O8/c1-15(20)4-9-6(5-22-15)12(16)10-7(23-9)3-8(21-2)13(17)11(10)14(18)19/h3,17,20H,4-5H2,1-2H3,(H,18,19)/t15-/m0/s1",COc1cc2oc3c(c(=O)c2c(C(=O)O)c1O)CO[C@](C)(O)C3,C15H14O8,,322.068867408,OIQRCBINTJVAGZ,Polyketides,Chromanes,Chromones,Penicillium brefeldianum,5310733.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Penicillium'],['Penicillium dodgei'],1,3,5.2862958908081055 9120,454,1267,Polyketides,Chromanes,Chromones,0.0,MS1_match,XLZRRNWHQQRALT-PEVLUNPASA-N,"InChI=1S/C21H24O10/c1-9-4-12(23)16-13(24)5-14-11(20(16)30-9)3-2-10(7-28-14)8-29-21-19(27)18(26)17(25)15(6-22)31-21/h2,4-5,15,17-19,21-22,24-27H,3,6-8H2,1H3/t15-,17-,18+,19-,21-/m1/s1",Cc1cc(=O)c2c(O)cc3c(c2o1)CC=C(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CO3,C21H24O10,pos_1_1proton2acetonitrile,436.136946968,XLZRRNWHQQRALT,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,3,7.5 9121,453,-1,,,,0.4049693,ISDB,,,,,,,FLJZRYZNZZHWSS,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6198772192001343 9122,451,1451,Fatty acids,Fatty Acids and Conjugates,Phenylethanoids,0.0,MS1_match,RKMQRPYLPSKVNS-UHFFFAOYSA-N,"InChI=1S/C6H10O4/c1-10-6(9)3-2-5(8)4-7/h7H,2-4H2,1H3",COC(=O)CCC(=O)CO,C6H10O4,pos_2MHCH3CN,146.0579088,RKMQRPYLPSKVNS,Fatty acids,Fatty Acids and Conjugates,,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,2,9.0 9123,446,1436,Terpenoids,Octadecanoids,Other Octadecanoids,0.41992632,ISDB,,,,,,,CQOAKBVRRVHWKV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.679705262184143 9124,445,593,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DPBCFTHDJGXWRI-ZYAMGDOSSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(19)16(2,14(7)23-5-8(6)18)25-15-13(22)12(21)11(20)9(4-17)24-15/h6-7,9-15,17,19-22H,3-5H2,1-2H3/t6-,7-,9-,10+,11-,12+,13-,14+,15+,16-/m1/s1",C[C@H]1C(=O)CO[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_sodium,362.157682412,DPBCFTHDJGXWRI,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9125,445,593,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBLVGADGVDUSHJ-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_sodium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9126,445,593,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,DBLVGADGVDUSHJ-RLIMOHGTSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(18)16(2,8(7)5-23-14(6)22)25-15-13(21)12(20)11(19)9(4-17)24-15/h6-13,15,17-21H,3-5H2,1-2H3/t6-,7+,8-,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@H]1C[C@H](O)[C@@]2(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H26O9,pos_1_sodium,362.157682412,DBLVGADGVDUSHJ,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 9127,445,593,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,RAKWYUWXLTYDQR-LTPIHACHSA-N,"InChI=1S/C16H26O9/c1-6-7-2-10(8(3-17)9(7)5-23-15(6)22)24-16-14(21)13(20)12(19)11(4-18)25-16/h6-14,16-21H,2-5H2,1H3/t6-,7-,8-,9+,10+,11-,12-,13+,14-,16-/m1/s1",C[C@H]1C(=O)OC[C@@H]2[C@@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]21,C16H26O9,pos_1_sodium,362.157682412,RAKWYUWXLTYDQR,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia gibbosa,231859.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia gibbosa'],6,3,7.5 9128,445,593,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_sodium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9129,445,593,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,ZHEBCILICLSWEG-XBNYBDERSA-N,"InChI=1S/C16H26O9/c1-6-7-3-10(16(2,22)8(7)5-23-14(6)21)25-15-13(20)12(19)11(18)9(4-17)24-15/h6-13,15,17-20,22H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15+,16+/m1/s1",C[C@H]1C(=O)OC[C@H]2[C@@H]1C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]2(C)O,C16H26O9,pos_1_sodium,362.15768241199993,ZHEBCILICLSWEG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9130,438,756,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,0.35284725,ISDB,MDAUFUALHVJQPD-ZPMBBQANSA-N,"InChI=1S/C45H70O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,38-39,42-46,49-51H,3-4,9-10,15-16,21-22,27-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-/t38-,39+,42-,43-,44+,45+/m0/s1",CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC,C45H70O10,,770.49689844,MDAUFUALHVJQPD,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Heterosigma akashiwo,427257.0,['Eukaryota'],['Unknown'],['Unknown'],['Raphidophyceae'],['Unknown'],['Unknown'],['Unknown'],['Heterosigma'],['Heterosigma akashiwo'],1,3,3.9113889932632446 9131,438,756,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,0.35284725,ISDB,MDAUFUALHVJQPD-BQBJNWOMSA-N,"InChI=1S/C45H70O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,38-39,42-46,49-51H,3-4,9-10,15-16,21-22,27-37H2,1-2H3/b7-5+,8-6+,13-11+,14-12+,19-17+,20-18+,25-23+,26-24+/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C/C/C=C/C/C=C/C/C=C/CCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCC/C=C/C/C=C/C/C=C/C/C=C/CC,C45H70O10,,770.49689844,MDAUFUALHVJQPD,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Heterosigma,725550.0,['Eukaryota'],['Unknown'],['Unknown'],['Raphidophyceae'],['Unknown'],['Unknown'],['Unknown'],['Heterosigma'],['Unknown'],1,3,3.9113889932632446 9132,436,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MNa,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9133,436,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MNa,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9134,436,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_2MNa,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9135,436,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MNa,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9136,436,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MNa,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9137,436,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_2MNa,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9138,436,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_2MNa,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9139,436,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_2MNa,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9140,436,-1,,,,0.0,MS1_match,NEVMWOQJRSZYIC-UUANRDTJSA-N,"InChI=1S/C30H36O18/c1-39-13-5-11-6-14(40-2)25(13)47-29-23(35)21(33)19(31)17(45-29)10-44-28(38)12-7-15(41-3)26(16(8-12)42-4)48-30-24(36)22(34)20(32)18(46-30)9-43-27(11)37/h5-8,17-24,29-36H,9-10H2,1-4H3/t17-,18-,19-,20-,21+,22+,23-,24-,29+,30+/m1/s1",COc1cc2cc(OC)c1O[C@@H]1O[C@H](COC(=O)c3cc(OC)c(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C30H36O18,pos_1_sodium,684.190164312,NEVMWOQJRSZYIC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 9141,433,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.40844408,ISDB,QNFGCJUWVHQNGF-XVHVLHHCSA-N,"InChI=1S/C13H20O3/c1-9-6-11(16)7-13(2,3)12(9)5-4-10(15)8-14/h4-6,10,12,14-15H,7-8H2,1-3H3/b5-4+/t10-,12-/m0/s1",CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@H](O)CO,C13H20O3,,224.1412445,QNFGCJUWVHQNGF,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Aglaia archboldiana,627550.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Aglaia'],['Aglaia archboldiana'],4,3,7.133776307106018 9142,428,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.24354401,ISDB,SBLZVJIHPWRSQQ-HNAYVOBHSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3/t15-,19+/m0/s1",COc1cc([C@H]2Oc3c(OC)cc(CCCO)cc3[C@@H]2CO)ccc1O,C20H24O6,,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Euonymus alatus,601141.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus alatus'],7,3,9.474176049232483 9143,427,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_1proton,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9144,426,213,Polyketides,Pseudoalkaloids,Terpenoid alkaloids,0.5126529,ISDB,,,,,,,IIRDTKBZINWQAW,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.0506114959716797 9145,425,-1,,,,0.7375663,ISDB,KQBASRSRJMDOBH-GOSISDBHSA-N,"InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-18-13-17-14-19(23-2)15-21(22)20(17)16-24-18/h14-15,18,22H,3-13,16H2,1-2H3/t18-/m1/s1",CCCCCCCCCCC[C@@H]1Cc2cc(OC)cc(O)c2CO1,C21H34O3,,334.250794948,KQBASRSRJMDOBH,Polyketides,Chromanes,Azaphilones,Ononis natrix,1072855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Trifolieae'],['Ononis'],['Ononis natrix'],4,0,6.950265169143677 9146,422,1629,Terpenoids,Sesquiterpenoids,Other Octadecanoids,0.4230985,ISDB,WTLVYAWQAPUBFY-UTLPMFLDSA-N,"InChI=1S/C18H28O4/c1-2-3-4-6-11-16(19)13-9-10-14-17(20)12-7-5-8-15-18(21)22/h9-10,13-14H,2-8,11-12,15H2,1H3,(H,21,22)/b13-9+,14-10+",CCCCCCC(=O)/C=C/C=C/C(=O)CCCCCC(=O)O,C18H28O4,,308.198759376,WTLVYAWQAPUBFY,Fatty acids,Octadecanoids,Other Octadecanoids,Ostodes paniculata,1028448.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Codiaeae'],['Ostodes'],['Ostodes paniculata'],4,3,7.192394018173218 9147,421,208,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,QRERZFJPBDZLNU-UHFFFAOYSA-N,"InChI=1S/C38H42N2O5/c1-39-14-12-25-19-27-20-30-37-26(21-36(43-4)38(30)44-5)13-15-40(2)32(37)17-24-8-11-33(41)35(18-24)45-28-9-6-23(7-10-28)16-31(39)29(25)22-34(27)42-3/h6-11,18-19,21-22,31-32,41H,12-17,20H2,1-5H3",COc1cc2c3cc1Cc1c(OC)c(OC)cc4c1C(Cc1ccc(O)c(c1)Oc1ccc(cc1)CC2N(C)CC3)N(C)CC4,C38H42N2O5,pos_2_2sodium,606.309372444,QRERZFJPBDZLNU,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 9148,416,517,Amino acids and Peptides,Amino acid glycosides,Pyridine alkaloids,0.43969935,ISDB,KQTRNMODDGXNSU-UUTXUICWSA-N,"InChI=1S/C18H27NO10/c1-8-13(22)10(21)4-12(26-8)27-9-2-3-18(5-9,7-19)29-17-16(25)15(24)14(23)11(6-20)28-17/h2-3,8-17,20-25H,4-6H2,1H3/t8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18-/m1/s1",C[C@H]1O[C@@H](O[C@H]2C=C[C@@](C#N)(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C2)C[C@H](O)[C@H]1O,C18H27NO10,,417.163496064,KQTRNMODDGXNSU,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Passiflora capsularis,992811.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora capsularis'],4,2,6.7587974071502686 9149,416,517,Amino acids and Peptides,Amino acid glycosides,Pyridine alkaloids,0.43969935,ISDB,KQTRNMODDGXNSU-UUTXUICWSA-N,"InChI=1S/C18H27NO10/c1-8-13(22)10(21)4-12(26-8)27-9-2-3-18(5-9,7-19)29-17-16(25)15(24)14(23)11(6-20)28-17/h2-3,8-17,20-25H,4-6H2,1H3/t8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18-/m1/s1",C[C@H]1O[C@@H](O[C@H]2C=C[C@@](C#N)(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C2)C[C@H](O)[C@H]1O,C18H27NO10,,417.163496064,KQTRNMODDGXNSU,Amino acids and Peptides,Amino acid glycosides,Cyanogenic glycosides,Passiflora citrina,362559.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora citrina'],4,2,6.7587974071502686 9150,415,-1,,,,0.63353646,ISDB,XSNMUAUBDFNEIO-SECBINFHSA-N,"InChI=1S/C15H16N2O2/c1-9(8-18)14-15-13(12(19-2)7-16-14)10-5-3-4-6-11(10)17-15/h3-7,9,17-18H,8H2,1-2H3/t9-/m1/s1",COc1cnc([C@H](C)CO)c2[nH]c3ccccc3c12,C15H16N2O2,,256.121177752,XSNMUAUBDFNEIO,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Picrasma quassioides,113667.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Simaroubaceae'],['Unknown'],['Picrasma'],['Picrasma quassioides'],4,0,6.534145832061768 9151,408,-1,,,,0.5277489,ISDB,APGVHKPCMRXAPJ-UHFFFAOYSA-N,"InChI=1S/C39H60O5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27-38(40)43-29-23-26-35-31-36(41-5)39(37(32-35)42-6)44-30-28-34(4)25-22-24-33(2)3/h11-12,14-15,23-24,26,28,31-32H,7-10,13,16-22,25,27,29-30H2,1-6H3",CCCCCC=CCC=CCCCCCCCC(=O)OCC=Cc1cc(OC)c(OCC=C(C)CCC=C(C)C)c(OC)c1,C39H60O5,,608.44407502,APGVHKPCMRXAPJ,,,,Ligularia nelumbifolia,896803.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Ligularia'],['Ligularia nelumbifolia'],4,0,6.110995531082153 9152,405,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.3708003,ISDB,ISNRCAHXJCTBAV-RMEWEKGHSA-N,"InChI=1S/C22H30O/c1-14-8-9-16-19(14)20-17(21(20,2)3)11-13-22(16)12-10-15-6-4-5-7-18(15)23-22/h4-7,14,16-17,19-20H,8-13H2,1-3H3/t14-,16+,17-,19-,20-,22+/m1/s1",C[C@@H]1CC[C@H]2[C@@H]1[C@H]1[C@@H](CC[C@@]23CCc2ccccc2O3)C1(C)C,C22H30O,,310.22966558,ISNRCAHXJCTBAV,Terpenoids,Diterpenoids,,Uvaria tanzaniae,3867912.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Uvaria'],['Uvaria tanzaniae'],4,1,5.9832011461257935 9153,404,109,Terpenoids,Diterpenoids,Estrane steroids,0.8979688,ISDB,KTPOZFYJWLGJGH-COMQUAJESA-N,"InChI=1S/C15H22O/c1-9-8-10(16)12-13-11(9)15(12,4)7-5-6-14(13,2)3/h8,11-13H,5-7H2,1-4H3/t11-,12+,13-,15+/m1/s1",CC1=CC(=O)[C@H]2[C@H]3[C@@H]1[C@]2(C)CCCC3(C)C,C15H22O,,218.167065324,KTPOZFYJWLGJGH,Terpenoids,Sesquiterpenoids,Longipinane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,1,10.091875314712524 9154,403,-1,,,,0.55605936,ISDB,MDUKNOYAUGMJTB-SPAOSGIGSA-N,"InChI=1S/C30H33NO7/c1-31(2)28(34)24-26(17-9-7-6-8-10-17)29(19-11-12-22(37-4)21(32)14-19)16-18-13-20(36-3)15-23(38-5)25(18)30(29,35)27(24)33/h6-15,24,26-27,32-33,35H,16H2,1-5H3/t24-,26-,27-,29-,30+/m1/s1",COc1cc2c(c(OC)c1)[C@]1(O)[C@H](O)[C@H](C(=O)N(C)C)[C@@H](c3ccccc3)[C@]1(c1ccc(OC)c(O)c1)C2,C30H33NO7,,519.225702396,MDUKNOYAUGMJTB,Shikimates and Phenylpropanoids,Stilbenoids,,Aglaia odorata,841346.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Aglaia'],['Aglaia odorata'],4,0,6.224237442016602 9155,401,-1,,,,0.39037216,ISDB,YNPUJIONBZSHJT-HEJXRFNBSA-N,"InChI=1S/C21H22O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17-24,26-28H,1H3/t8-,15+,17-,18+,19-,20-,21-/m1/s1",C[C@H]1O[C@H](Oc2cc(O)c3c(c2)O[C@H](c2ccc(O)cc2)[C@@H](O)C3=O)[C@H](O)[C@H](O)[C@H]1O,C21H22O10,,434.121296904,YNPUJIONBZSHJT,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Hypericum japonicum,878899.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Hypericaceae'],['Hypericeae'],['Hypericum'],['Hypericum japonicum'],4,0,5.561488628387451 9156,401,-1,,,,0.39037216,ISDB,YNPUJIONBZSHJT-IXOMFOKQSA-N,"InChI=1S/C21H22O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17-24,26-28H,1H3/t8-,15-,17+,18-,19+,20-,21-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@@H](c2ccc(O)cc2)[C@@H](O)C3=O)[C@H](O)[C@H](O)[C@H]1O,C21H22O10,,434.121296904,YNPUJIONBZSHJT,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Chengiopanax sciadophylloides,989139.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Chengiopanax'],['Chengiopanax sciadophylloides'],4,0,5.561488628387451 9157,400,38,Terpenoids,Steroids,Cholestane steroids,0.57814354,ISDB,GQVCGTRDXSDAHC-UHFFFAOYSA-N,"InChI=1S/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3",COC1C=C2C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC2C2(C)CCC(O)CC12O,C29H48O3,,444.360345396,GQVCGTRDXSDAHC,Terpenoids,Steroids,Cholestane steroids,Trewia nudiflora,375532.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus nudiflorus'],4,3,7.812574148178101 9158,400,38,Terpenoids,Steroids,Cholestane steroids,0.57814354,ISDB,GQVCGTRDXSDAHC-DDUFMXSOSA-N,"InChI=1S/C29H48O3/c1-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(32-7)29(31)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h8-9,16,18-21,23-26,30-31H,10-15,17H2,1-7H3/b9-8+/t19-,20+,21-,23+,24-,25-,26-,27+,28+,29-/m0/s1",CO[C@H]1C=C2[C@@H]3CC[C@H]([C@H](C)/C=C/[C@H](C)C(C)C)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC[C@H](O)C[C@]12O,C29H48O3,,444.360345396,GQVCGTRDXSDAHC,Terpenoids,Steroids,Cholestane steroids,Mallotus nudiflorus,375532.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Acalypheae'],['Mallotus'],['Mallotus nudiflorus'],4,3,7.812574148178101 9159,399,-1,,,,0.5277122,ISDB,VXCKZKCKFMIQKD-GFCCVEGCSA-N,"InChI=1S/C15H14O3/c1-8(2)12-7-10-14(17-12)13-9(3)5-4-6-11(13)18-15(10)16/h4-6,12H,1,7H2,2-3H3/t12-/m1/s1",C=C(C)[C@H]1Cc2c(c3c(C)cccc3oc2=O)O1,C15H14O3,,242.094294308,VXCKZKCKFMIQKD,Shikimates and Phenylpropanoids,Coumarins,Furocoumarins,Ekebergia pterophylla,1076020.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Meliaceae'],['Unknown'],['Ekebergia'],['Ekebergia pterophylla'],4,0,6.110848903656006 9160,398,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.5399866,ISDB,SWYRVCGNMNAFEK-WENAFLHNSA-N,"InChI=1S/C19H30O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-7,11,13-17,20,22-25H,8-9H2,1-4H3/b6-5+/t11-,13-,14-,15+,16-,17+,19-/m1/s1",CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C19H30O8,,386.19406792,SWYRVCGNMNAFEK,Terpenoids,Apocarotenoids,Megastigmanes,Epimedium grandiflorum,655264.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Berberidaceae'],['Unknown'],['Epimedium'],['Epimedium grandiflorum'],5,2,8.15994644165039 9161,397,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_2MNa,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9162,397,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_2MNa,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9163,395,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 9164,395,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 9165,395,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 9166,395,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Delphinium consolida,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 9167,395,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Consolida regalis,733334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida regalis'],6,0,6.0 9168,395,-1,,,,0.0,MS1_match,VKOBVWXKNCXXDE-UHFFFAOYSA-N,"InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)",CCCCCCCCCCCCCCCCCCCC(=O)O,C20H40O2,pos_1_1proton1acetonitrile,312.30283052,VKOBVWXKNCXXDE,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Ranunculus sceleratus,747491.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sceleratus'],6,0,6.0 9169,391,-1,,,,0.24156381,ISDB,GZIOHXRVLOOKSP-QYJDRXKLSA-N,"InChI=1S/C25H34O/c1-15(2)17-7-9-23(4)13-18-21(12-20(17)23)25-11-6-16(3)19(25)8-10-24(25,5)22(18)14-26/h12,14-16,19H,6-11,13H2,1-5H3/t16-,19+,23+,24+,25-/m1/s1",CC(C)C1=C2C=C3C(=C(C=O)[C@]4(C)CC[C@H]5[C@H](C)CC[C@]354)C[C@]2(C)CC1,C25H34O,,350.260965708,GZIOHXRVLOOKSP,Terpenoids,Diterpenoids,Dolastane diterpenoids,Aspergillus stellatus,397551.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Eurotiomycetes'],['Eurotiales'],['Trichocomaceae'],['Unknown'],['Aspergillus'],['Aspergillus stellatus'],1,0,1.966255247592926 9170,390,47,Fatty acids,Fatty acyls,Fatty aldehydes,0.0,MS1_match,YIWUKEYIRIRTPP-UHFFFAOYSA-N,"InChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3",CCCCC(CC)CO,C8H18O,pos_2MHCH3CN,130.135765196,YIWUKEYIRIRTPP,Fatty acids,Fatty acyls,Fatty alcohols,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,8.0 9171,388,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.31790483,ISDB,BMQNSHDVIYZULR-FZJJXLMSSA-N,"InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-26,36,41H,27-29H2,1-10H3/b12-11+,18-13-,19-14-,25-23+,26-24+,30-16+,31-17+,32-20-,33-21-",CC1=C(/C=C/C(C)=C\C=C/C(C)=C/C=C/C=C(C)/C=C\C=C(C)/C=C/C2=C(C)CC(O)CC2(C)C)C(C)(C)CC=C1,C40H54O,,550.417466348,BMQNSHDVIYZULR,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,8.771619319915771 9172,386,-1,,,,0.0,MS1_match,LAGBIQKFHSDYJZ-GADKELDLSA-N,"InChI=1S/C22H35NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-19,24-26H,1,3-13H2,2H3/t15-,16+,17-,18+,19+,20-,21-,22+/m0/s1",C=C1[C@H]2CC[C@@]3([C@H](O)C[C@@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@@H]3C2)[C@@H]1O,C22H35NO3,pos_1_1proton1methanol,361.26169398,LAGBIQKFHSDYJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium oliverianum,733345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida oliveriana'],6,0,6.0 9173,386,-1,,,,0.0,MS1_match,LAGBIQKFHSDYJZ-GADKELDLSA-N,"InChI=1S/C22H35NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-19,24-26H,1,3-13H2,2H3/t15-,16+,17-,18+,19+,20-,21-,22+/m0/s1",C=C1[C@H]2CC[C@@]3([C@H](O)C[C@@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@@H]3C2)[C@@H]1O,C22H35NO3,pos_1_1proton1methanol,361.26169398,LAGBIQKFHSDYJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 9174,386,-1,,,,0.0,MS1_match,LAGBIQKFHSDYJZ-GADKELDLSA-N,"InChI=1S/C22H35NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-19,24-26H,1,3-13H2,2H3/t15-,16+,17-,18+,19+,20-,21-,22+/m0/s1",C=C1[C@H]2CC[C@@]3([C@H](O)C[C@@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@@H]3C2)[C@@H]1O,C22H35NO3,pos_1_1proton1methanol,361.26169398,LAGBIQKFHSDYJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida ambigua,693548.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ambigua'],6,0,6.0 9175,386,-1,,,,0.0,MS1_match,LAGBIQKFHSDYJZ-SVMKMBGISA-N,"InChI=1S/C22H35NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-19,24-26H,1,3-13H2,2H3/t15-,16-,17+,18+,19+,20-,21-,22+/m0/s1",C=C1[C@H]2CC[C@@]3([C@H](O)C[C@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@H]3C2)[C@@H]1O,C22H35NO3,pos_1_1proton1methanol,361.26169398,LAGBIQKFHSDYJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Consolida pubescens,733338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida pubescens'],6,0,6.0 9176,386,-1,,,,0.0,MS1_match,LAGBIQKFHSDYJZ-SVMKMBGISA-N,"InChI=1S/C22H35NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-19,24-26H,1,3-13H2,2H3/t15-,16-,17+,18+,19+,20-,21-,22+/m0/s1",C=C1[C@H]2CC[C@@]3([C@H](O)C[C@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@H]3C2)[C@@H]1O,C22H35NO3,pos_1_1proton1methanol,361.26169398,LAGBIQKFHSDYJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pubescens,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 9177,386,-1,,,,0.0,MS1_match,LAGBIQKFHSDYJZ-SVMKMBGISA-N,"InChI=1S/C22H35NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-19,24-26H,1,3-13H2,2H3/t15-,16-,17+,18+,19+,20-,21-,22+/m0/s1",C=C1[C@H]2CC[C@@]3([C@H](O)C[C@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@H]3C2)[C@@H]1O,C22H35NO3,pos_1_1proton1methanol,361.26169398,LAGBIQKFHSDYJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ambiguum,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 9178,386,-1,,,,0.0,MS1_match,LAGBIQKFHSDYJZ-SVMKMBGISA-N,"InChI=1S/C22H35NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-19,24-26H,1,3-13H2,2H3/t15-,16-,17+,18+,19+,20-,21-,22+/m0/s1",C=C1[C@H]2CC[C@@]3([C@H](O)C[C@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@H]3C2)[C@@H]1O,C22H35NO3,pos_1_1proton1methanol,361.26169398,LAGBIQKFHSDYJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,0,6.0 9179,386,-1,,,,0.0,MS1_match,BNNSBUJXIHFJBX-SFTNKBJPSA-N,"InChI=1S/C22H35NO3/c1-4-23-10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12+,13-,14+,15+,16+,17-,18+,19+,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@]12C[C@H]([C@H](C)[C@H]1O)[C@H](O)C[C@H]24,C22H35NO3,pos_1_1proton1methanol,361.26169398,BNNSBUJXIHFJBX,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,0,6.0 9180,386,-1,,,,0.0,MS1_match,VFRHLKNINNUPQV-IUCVIKEYSA-N,"InChI=1S/C22H35NO3/c1-14-10-17-21(4,19(26)15(14)2)18(25)11-16-20(3)6-5-7-22(16,17)13-23(12-20)8-9-24/h9,14,16-19,25-26H,2,5-8,10-13H2,1,3-4H3/t14-,16+,17+,18+,19+,20-,21+,22-/m0/s1",C=C1[C@@H](O)[C@@]2(C)[C@H](O)C[C@@H]3[C@@]4(C)CCC[C@@]3(CN(CC=O)C4)[C@@H]2C[C@@H]1C,C22H35NO3,pos_1_1proton1methanol,361.26169398,VFRHLKNINNUPQV,Terpenoids,Diterpenoids,,Consolida orientalis,701719.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida orientalis'],6,0,6.0 9181,386,-1,,,,0.0,MS1_match,HYRPLPZQZOSPPF-VZSSTYFJSA-N,"InChI=1S/C22H35NO3/c1-4-23-11-20(2)7-6-16(26-3)22-13-9-12-5-8-21(25,17(13)18(12)24)14(19(22)23)10-15(20)22/h12-19,24-25H,4-11H2,1-3H3/t12-,13+,14-,15+,16+,17+,18-,19+,20-,21-,22+/m0/s1",CCN1C[C@]2(C)CC[C@@H](OC)[C@@]34[C@@H]5C[C@@H]6CC[C@@](O)([C@H]5[C@H]6O)[C@@H](C[C@H]23)[C@@H]14,C22H35NO3,pos_1_1proton1methanol,361.26169398,HYRPLPZQZOSPPF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium souliei,6131807.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium souliei'],6,0,6.0 9182,385,-1,,,,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton1ammonium,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9183,385,-1,,,,0.0,MS1_match,SMFKCIHIAHWGGL-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(13(21)8-17)26-14(22)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-21,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)C1,C17H20O9,pos_1_1proton1ammonium,368.11073222,SMFKCIHIAHWGGL,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9184,385,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton1ammonium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9185,385,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton1ammonium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9186,385,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-LQMUPLJOSA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C17H20O9,pos_1_1proton1ammonium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9187,385,-1,,,,0.0,MS1_match,MZNIJRAPCCELQX-AWOKGZDASA-N,"InChI=1S/C17H20O9/c1-25-16(23)17(24)7-12(20)15(22)13(8-17)26-14(21)5-3-9-2-4-10(18)11(19)6-9/h2-6,12-13,15,18-20,22,24H,7-8H2,1H3/b5-3+/t12-,13-,15-,17+/m1/s1",COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C17H20O9,pos_1_1proton1ammonium,368.1107322199999,MZNIJRAPCCELQX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9188,384,476,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_2MHNH3,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 9189,382,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.59199685,ISDB,DBHKHNGBVGWQJE-USWSLJGRSA-N,"InChI=1S/C23H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h6-7,9-10,22,25H,2-5,8,11-21,24H2,1H3,(H,27,28)/b7-6-,10-9-/t22-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OCCN,C23H44NO7P,,477.285539378,DBHKHNGBVGWQJE,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,0,6.367987394332886 9190,380,-1,,,,0.52485895,ISDB,PSQYTAPXSHCGMF-BQYQJAHWSA-N,"InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+",CC(=O)/C=C/C1=C(C)CCCC1(C)C,C13H20O,,192.15141526,PSQYTAPXSHCGMF,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,8.099435806274414 9191,379,-1,,,,0.3180205,ISDB,BYGFDSFPDBVAMG-LDLBKJIOSA-N,"InChI=1S/C39H62O6/c1-9-10-11-12-13-16-35(41)44-23-14-15-34-32(29(4)26-40)21-22-38(8,43)39(34)25-31(45-36(39)42)24-27(2)17-20-33-28(3)18-19-30(5)37(33,6)7/h17,20,24,26,30-31,34,36,42-43H,9-16,18-19,21-23,25H2,1-8H3/b20-17+,27-24+,32-29-/t30-,31-,34+,36+,38-,39-/m0/s1",CCCCCCCC(=O)OCCC[C@@H]1/C(=C(/C)C=O)CC[C@](C)(O)[C@@]12C[C@H](/C=C(C)/C=C/C1=C(C)CC[C@H](C)C1(C)C)O[C@H]2O,C39H62O6,,626.454639704,BYGFDSFPDBVAMG,Terpenoids,,,Iris hoogiana,248945.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Iridaceae'],['Irideae'],['Iris'],['Iris hoogiana'],4,0,5.272081971168518 9192,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana rossica,6061718.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana rossica'],6,2,7.0 9193,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana amurensis,245959.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana amurensis'],6,2,7.0 9194,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana cardamines,6061598.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana cardamines'],6,2,7.0 9195,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana eriophylla,6061633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana eriophylla'],6,2,7.0 9196,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Lomelosia caucasica,994163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lomelosia'],['Lomelosia caucasica'],6,2,7.0 9197,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana ficariifolia,5746450.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana ficariifolia'],6,2,7.0 9198,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana chionophila,6061606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana chionophila'],6,2,7.0 9199,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Valeriana fedtschenkoi,139316.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana longiflora'],6,2,7.0 9200,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,2,7.0 9201,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,2,7.0 9202,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Abelia chinensis,589178.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Abelia'],['Abelia chinensis'],6,2,7.0 9203,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia tatarica,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 9204,376,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,KZNIFHPLKGYRTM-UHFFFAOYSA-N,"InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H",O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C15H10O5,pos_1_1proton,270.05282342,KZNIFHPLKGYRTM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Knautia montana,5512969.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Knautia'],['Knautia montana'],6,2,7.0 9205,375,-1,,,,0.0,MS1_match,GWMRACWLCOWLPK-UHFFFAOYSA-N,"InChI=1S/C30H40N2O/c1-28-10-4-11-30-25-14-20-13-23-27(30)32(18-28)24(26(28)30)16-29(23,25)15-21(20)17-33-22-7-5-19(6-8-22)9-12-31(2)3/h5-8,15,20,23-27H,4,9-14,16-18H2,1-3H3",CN(C)CCc1ccc(OCC2=CC34CC5C6C7(C)CCCC68C(C3CC2CC48)N5C7)cc1,C30H40N2O,pos_1_minus1proton2sodium,444.3140639,GWMRACWLCOWLPK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum seravschanicum,395973.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum seravschanicum'],6,0,6.0 9206,374,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.48338047,ISDB,BCNPTKKIVMTZFO-BWEORVRESA-N,"InChI=1S/C22H30O2/c1-17(9-6-7-14-23)10-8-11-18(2)12-13-21-19(3)15-20(24)16-22(21,4)5/h6-14,20,24H,15-16H2,1-5H3/b7-6+,10-8+,13-12+,17-9-,18-11+/t20-/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C\C=C\C=O)C(C)(C)C[C@H](O)C1,C22H30O2,,326.2245802,BCNPTKKIVMTZFO,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],0,1,2.433521866798401 9207,374,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.48338047,ISDB,BCNPTKKIVMTZFO-UHFFFAOYSA-N,"InChI=1S/C22H30O2/c1-17(9-6-7-14-23)10-8-11-18(2)12-13-21-19(3)15-20(24)16-22(21,4)5/h6-14,20,24H,15-16H2,1-5H3",CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=O,C22H30O2,,326.2245802,BCNPTKKIVMTZFO,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],0,1,2.433521866798401 9208,373,903,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.36936715,ISDB,NGSWKAQJJWESNS-ZZXKWVIFSA-N,"InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+",O=C(O)/C=C/c1ccc(O)cc1,C9H8O3,,164.047344116,NGSWKAQJJWESNS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,9.977468609809875 9209,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 9210,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 9211,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9212,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9213,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 9214,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 9215,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 9216,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9217,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9218,372,-1,,,,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_2MK,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 9219,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,YRUSHCSMDUSKBH-UHFFFAOYSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(28-12(3)26)13-10-23(14,17)20(27)11(13)2/h13-21,27H,2,5-10H2,1,3-4H3",C=C1C2CC3(C1O)C1CC4C5(C)CCC6OC5N(CC)C1C64C3CC2OC(C)=O,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,YRUSHCSMDUSKBH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,3,7.5 9220,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,YRUSHCSMDUSKBH-APIIFMLZSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(28-12(3)26)13-10-23(14,17)20(27)11(13)2/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14-,15-,16-,17-,18-,19+,20-,21+,22+,23-,24-/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1O)[C@@H]1C[C@@H]4[C@]5(C)CC[C@H]6O[C@@H]5N(CC)[C@@H]1[C@@]46[C@@H]3C[C@H]2OC(C)=O,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,YRUSHCSMDUSKBH,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 9221,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,ZHCWRURMFHHTTG-RAGRHMKSSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(27)13-10-23(14,17)20(11(13)2)28-12(3)26/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14+,15+,16-,17-,18+,19?,20-,21?,22-,23+,24+/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1OC(C)=O)[C@@H](C[C@@H]2O)[C@@]12C4[C@@H]3C[C@@H]1[C@@]1(C)CC[C@@H]2OC1N4CC,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,ZHCWRURMFHHTTG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pendulum,488232.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum pendulum'],6,3,7.5 9222,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,ZHCWRURMFHHTTG-ZZNDXBCWSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(27)13-10-23(14,17)20(11(13)2)28-12(3)26/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14+,15+,16-,17-,18+,19+,20-,21-,22-,23+,24+/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1OC(C)=O)[C@@H](C[C@@H]2O)[C@]12[C@@H]4CC[C@]5(C)[C@H]1C[C@H]3[C@@H]2N(CC)[C@@H]5O4,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,ZHCWRURMFHHTTG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,3,7.5 9223,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,ZHCWRURMFHHTTG-AFGOMOFOSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(27)13-10-23(14,17)20(11(13)2)28-12(3)26/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14-,15+,16-,17-,18-,19+,20-,21+,22+,23-,24-/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1OC(C)=O)[C@@H]1C[C@@H]4[C@]5(C)CC[C@H]6O[C@@H]5N(CC)[C@@H]1[C@@]46[C@@H]3C[C@@H]2O,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,ZHCWRURMFHHTTG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum sachalinense,1064657.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum sachalinense'],6,3,7.5 9224,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,ZHCWRURMFHHTTG-ZDIIOSBQSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(27)13-10-23(14,17)20(11(13)2)28-12(3)26/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14+,15-,16-,17-,18+,19+,20-,21-,22-,23+,24+/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1OC(C)=O)[C@@H](C[C@H]2O)[C@]12[C@@H]4CC[C@]5(C)[C@H]1C[C@H]3[C@@H]2N(CC)[C@@H]5O4,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,ZHCWRURMFHHTTG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kongboense,723190.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kongboense'],6,3,7.5 9225,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,ZHCWRURMFHHTTG-ZDIIOSBQSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-8-16-22(4)7-6-18(29-21(22)25)24(16,19)17-9-15(27)13-10-23(14,17)20(11(13)2)28-12(3)26/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14+,15-,16-,17-,18+,19+,20-,21-,22-,23+,24+/m1/s1",C=C1[C@H]2C[C@@]3([C@@H]1OC(C)=O)[C@@H](C[C@H]2O)[C@]12[C@@H]4CC[C@]5(C)[C@H]1C[C@H]3[C@@H]2N(CC)[C@@H]5O4,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,ZHCWRURMFHHTTG,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,3,7.5 9226,365,138,Terpenoids,Monoterpenoids,Terpenoid alkaloids,0.0,MS1_match,ZJQGYZLTPGHVJZ-QNELILJHSA-N,"InChI=1S/C24H33NO4/c1-5-25-19-14-10-15-22(4)8-7-16(29-21(22)25)24(15,19)18-17(28-12(3)26)13-6-9-23(14,18)20(27)11(13)2/h13-21,27H,2,5-10H2,1,3-4H3/t13-,14-,15+,16-,17-,18+,19+,20-,21+,22+,23+,24+/m0/s1",C=C1[C@@H]2CC[C@@]3([C@@H]([C@H]2OC(C)=O)[C@]24[C@@H]5CC[C@]6(C)[C@H]2C[C@H]3[C@H]4N(CC)[C@@H]6O5)[C@H]1O,C24H33NO4,pos_1_minus1proton2potassium,399.240958536,ZJQGYZLTPGHVJZ,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum barbatum,625500.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum barbatum'],6,3,7.5 9227,358,671,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,KOWMJRJXZMEZLD-HCIHMXRSSA-N,"InChI=1S/C22H26O8/c1-25-15-5-11(6-16(26-2)19(15)23)21-13-9-30-22(14(13)10-29-21)12-7-17(27-3)20(24)18(8-12)28-4/h5-8,13-14,21-24H,9-10H2,1-4H3/t13-,14-,21+,22+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2cc(OC)c(O)c(OC)c2)cc(OC)c1O,C22H26O8,pos_1_sodium,418.162767792,KOWMJRJXZMEZLD,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 9228,358,671,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,0.0,MS1_match,KOWMJRJXZMEZLD-HCIHMXRSSA-N,"InChI=1S/C22H26O8/c1-25-15-5-11(6-16(26-2)19(15)23)21-13-9-30-22(14(13)10-29-21)12-7-17(27-3)20(24)18(8-12)28-4/h5-8,13-14,21-24H,9-10H2,1-4H3/t13-,14-,21+,22+/m0/s1",COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2cc(OC)c(O)c(OC)c2)cc(OC)c1O,C22H26O8,pos_1_sodium,418.162767792,KOWMJRJXZMEZLD,Shikimates and Phenylpropanoids,Lignans,Furofuranoid lignans,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],8,3,9.5 9229,357,237,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.2051889,ISDB,TXLXNBLWYBIYQL-UHFFFAOYSA-N,"InChI=1S/C25H22O11/c26-7-17-20(28)21(29)22(30)25(35-17)36-23-14(27)3-1-10-5-12-13(8-32-24(12)31)18(19(10)23)11-2-4-15-16(6-11)34-9-33-15/h1-6,17,20-22,25-30H,7-9H2",O=C1OCc2c1cc1ccc(O)c(OC3OC(CO)C(O)C(O)C3O)c1c2-c1ccc2c(c1)OCO2,C25H22O11,,498.116211524,TXLXNBLWYBIYQL,Shikimates and Phenylpropanoids,,,Justicia hyssopifolia,6077298.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Acanthaceae'],['Justicieae'],['Justicia'],['Justicia hyssopifolia'],4,1,5.32075560092926 9230,356,-1,,,,0.0,MS1_match,YXWUKVNWHJHQJJ-MIWXEKCFSA-N,"InChI=1S/C20H30O12/c1-8-13(23)15(25)17(27)19(30-8)29-7-12-14(24)16(26)18(28)20(32-12)31-11-6-9(4-5-21)2-3-10(11)22/h2-3,6,8,12-28H,4-5,7H2,1H3/t8-,12+,13-,14+,15+,16-,17+,18+,19+,20+/m1/s1",C[C@H]1O[C@H](OC[C@@H]2O[C@H](Oc3cc(CCO)ccc3O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C20H30O12,pos_1_1proton1ammonium,462.1737264,YXWUKVNWHJHQJJ,Shikimates and Phenylpropanoids,Phenylethanoids (C6-C2),Phenylethanoids,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,0,8.0 9231,352,-1,,,,0.3739272,ISDB,LAYQBSCEPAXXNJ-JVMZRJCASA-N,"InChI=1S/C18H28O9/c1-9(26-18-17(25)16(24)15(23)13(8-19)27-18)3-2-4-11-10(7-14(21)22)5-6-12(11)20/h2-3,9-11,13,15-19,23-25H,4-8H2,1H3,(H,21,22)/b3-2-/t9-,10-,11+,13-,15-,16+,17-,18-/m1/s1",C[C@H](/C=C\C[C@@H]1C(=O)CC[C@@H]1CC(=O)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C18H28O9,,388.173332476,LAYQBSCEPAXXNJ,Fatty acids,Fatty acyl glycosides,Fatty acyl glycosides of mono- and disaccharides,Solanum tuberosum,494835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum tuberosum'],4,0,5.4957088232040405 9232,350,-1,,,,0.0,MS1_match,DYNOEUZCEHQMPL-IDPWYUCISA-N,"InChI=1S/C37H50N2O11/c1-7-38-17-33(18-50-31(42)20-10-8-9-11-22(20)39-25(40)14-19(2)30(39)41)13-12-24(47-4)36-28(33)29(49-6)37(45,32(36)38)35(44)16-23(46-3)21-15-34(36,43)27(35)26(21)48-5/h8-11,19,21,23-24,26-29,32,43-45H,7,12-18H2,1-6H3/t19-,21-,23+,24+,26+,27+,28-,29+,32+,33+,34+,35-,36-,37+/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)C[C@@H](C)C3=O)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC,C37H50N2O11,pos_1_1proton1ethylamine,698.34146042,DYNOEUZCEHQMPL,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium dissectum,6131641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium dissectum'],6,0,6.0 9233,349,-1,,,,0.0,MS1_match,FQTLCLSUCSAZDY-UHFFFAOYSA-N,"InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3",C=CC(C)(O)CCC=C(C)CCC=C(C)C,C15H26O,pos_1_sodium,222.198365452,FQTLCLSUCSAZDY,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9234,349,-1,,,,0.0,MS1_match,AYXPYQRXGNDJFU-UHFFFAOYSA-N,"InChI=1S/C15H26O/c1-9-5-6-10-12(9)13-11(14(13,2)3)7-8-15(10,4)16/h9-13,16H,5-8H2,1-4H3",CC1CCC2C1C1C(CCC2(C)O)C1(C)C,C15H26O,pos_1_sodium,222.198365452,AYXPYQRXGNDJFU,Terpenoids,Sesquiterpenoids,Aromadendrane sesquiterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9235,349,-1,,,,0.0,MS1_match,CRDAMVZIKSXKFV-YFVJMOTDSA-N,"InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9+,15-11+",CC(C)=CCC/C(C)=C/CC/C(C)=C/CO,C15H26O,pos_1_sodium,222.198365452,CRDAMVZIKSXKFV,Terpenoids,Monoterpenoids,Acyclic monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9236,348,532,Terpenoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,XLYZUCCPECGBHX-GHCRHULKSA-N,"InChI=1S/C24H32O9/c1-12-7-8-16(30-13(2)25)23(6)20(32-21(28)15-9-10-29-11-15)18(27)17-19(31-14(3)26)24(12,23)33-22(17,4)5/h9-12,16-20,27H,7-8H2,1-6H3/t12-,16+,17-,18-,19-,20+,23+,24-/m1/s1",CC(=O)O[C@H]1CC[C@@H](C)[C@]23OC(C)(C)[C@H]([C@@H](O)[C@H](OC(=O)c4ccoc4)[C@]12C)[C@H]3OC(C)=O,C24H32O9,pos_2_1proton1potassium,464.204632604,XLYZUCCPECGBHX,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus boaria,418513.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus boaria'],6,2,7.0 9237,347,188,Shikimates and Phenylpropanoids,Flavonoids,Flavanones,0.46404046,ISDB,HAJRFFOSWOEITM-WKYRQYEVSA-N,"InChI=1S/C20H28O13/c1-6(22)12-9(23)3-8(4-10(12)24)31-20-18(16(28)14(26)11(5-21)32-20)33-19-17(29)15(27)13(25)7(2)30-19/h3-4,7,11,13-21,23-29H,5H2,1-2H3/t7-,11+,13-,14+,15+,16-,17+,18+,19-,20+/m0/s1",CC(=O)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1O,C20H28O13,,476.1529909559998,HAJRFFOSWOEITM,Polyketides,Phloroglucinols,Acyl phloroglucinols,Bursera simaruba,841945.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Burseraceae'],['Unknown'],['Bursera'],['Bursera simaruba'],4,0,5.856161832809448 9238,344,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.58174324,ISDB,PAUIQDPAEDELMC-CKBMHYDUSA-N,"InChI=1S/C25H34O2/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-24-22(4)16-23(27)17-25(24,5)6/h7-15,18,23,27H,16-17H2,1-6H3/b8-7+,12-9+,15-14+,19-10-,20-13+,21-11+/t23-/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C\C=C\C=C(/C)C=O)C(C)(C)C[C@H](O)C1,C25H34O2,,366.255880328,PAUIQDPAEDELMC,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],0,1,2.8269729614257812 9239,344,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.58174324,ISDB,PAUIQDPAEDELMC-HEZGKBSMSA-N,"InChI=1S/C25H34O2/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-24-22(4)16-23(27)17-25(24,5)6/h7-15,18,23,27H,16-17H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13+,21-11+/t23-/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(\C)C=O)C(C)(C)C[C@H](O)C1,C25H34O2,,366.255880328,PAUIQDPAEDELMC,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Flavobacterium,174848.0,['Bacteria'],['Unknown'],['Bacteroidetes'],['Flavobacteria'],['Flavobacteriales'],['Flavobacteriaceae'],['Unknown'],['Flavobacterium'],['Unknown'],0,1,2.8269729614257812 9240,343,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QQRSPHJOOXUALR-UHFFFAOYSA-N,"InChI=1S/C12H14O4/c1-4-5-8-6-9(13-2)11-12(10(8)14-3)16-7-15-11/h4,6H,1,5,7H2,2-3H3",C=CCc1cc(OC)c2c(c1OC)OCO2,C12H14O4,pos_1_1proton1methanol,222.089208928,QQRSPHJOOXUALR,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 9241,343,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ATJVZXXHKSYELS-FNORWQNLSA-N,"InChI=1S/C12H14O4/c1-3-16-12(14)7-5-9-4-6-10(13)11(8-9)15-2/h4-8,13H,3H2,1-2H3/b7-5+",CCOC(=O)/C=C/c1ccc(O)c(OC)c1,C12H14O4,pos_1_1proton1methanol,222.089208928,ATJVZXXHKSYELS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Coptis japonica,387829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Coptis'],['Coptis japonica'],6,3,7.5 9242,341,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.37740466,ISDB,ZFHFRLPFRLZAPJ-IVOUXGOCSA-N,"InChI=1S/C51H82O15/c1-25-24-61-42(27(3)26(25)2)65-40-37(56)36(55)39(41(58)60-11)64-44(40)63-33-15-16-48(8)31(47(33,6)7)14-17-50(10)32(48)13-12-28-29-22-46(4,5)18-20-51(29,21-19-49(28,50)9)45(59)66-43-38(57)35(54)34(53)30(23-52)62-43/h12,25-27,29-40,42-44,52-57H,13-24H2,1-11H3/t25-,26+,27-,29+,30-,31+,32-,33+,34-,35+,36+,37+,38-,39+,40-,42+,43+,44-,48+,49-,50-,51+/m1/s1",COC(=O)[C@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC=C5[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]5(C)[C@]4(C)CC[C@H]3C2(C)C)[C@H](O[C@@H]2OC[C@@H](C)[C@H](C)[C@H]2C)[C@@H](O)[C@@H]1O,C51H82O15,,934.565371924,ZFHFRLPFRLZAPJ,Terpenoids,Triterpenoids,Oleanane triterpenoids,Panax stipuleanatus,160834.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax stipuleanatus'],4,0,5.509618639945984 9243,338,-1,,,,0.43042764,ISDB,IPRPPFIAVHPVJH-UHFFFAOYSA-N,"InChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2",O=CCc1ccc(O)cc1,C8H8O2,,136.052429496,IPRPPFIAVHPVJH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis parviloba,5737758.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis parviloba'],8,0,9.721710562705994 9244,337,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2962483,ISDB,YRVYJYODXYESHQ-PHSZKTHRSA-N,"InChI=1S/C45H72O11/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-20-24-28-40(48)53-33-36(34-54-45-44(52)43(51)42(50)39(32-46)56-45)55-41(49)29-25-21-18-19-23-26-35-30-31-38(47)37(35)27-22-6-4-2/h5-7,9-10,12-13,22,30-31,35-37,39,42-46,50-52H,3-4,8,11,14-21,23-29,32-34H2,1-2H3/b7-5-,10-9-,13-12-,22-6-/t35-,36+,37-,39+,42-,43-,44+,45+/m0/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC[C@H]1C=CC(=O)[C@H]1C/C=C\CC,C45H72O11,,788.507463124,YRVYJYODXYESHQ,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,0,5.184993147850037 9245,335,109,Terpenoids,Diterpenoids,Estrane steroids,0.680454,ISDB,NPAGDVCDWIYMMC-IZPLOLCNSA-N,"InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1",C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2O,C18H26O2,,274.193280072,NPAGDVCDWIYMMC,Terpenoids,Steroids,Estrane steroids,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.221816062927246 9246,334,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1proton1ammonium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 9247,334,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_1proton1ammonium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 9248,333,-1,,,,0.36739108,ISDB,LBFWHQSJIPPDSZ-UHFFFAOYSA-N,"InChI=1S/C37H66O5/c1-3-4-5-6-7-8-14-17-20-23-26-33(38)35-28-29-36(42-35)34(39)27-24-21-18-15-12-10-9-11-13-16-19-22-25-32-30-31(2)41-37(32)40/h17,20,30-31,33-36,38-39H,3-16,18-19,21-29H2,1-2H3",CCCCCCCCC=CCCC(O)C1CCC(C(O)CCCCCCCCCCCCCCC2=CC(C)OC2=O)O1,C37H66O5,,590.491025212,LBFWHQSJIPPDSZ,Polyketides,Linear polyketides,Acetogenins,Annona squamosa,915056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona squamosa'],4,0,5.469564318656921 9249,330,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.27643418,ISDB,MXINPMPTHWBNPF-AMQQOLNISA-N,"InChI=1S/C30H39NO6/c1-15-10-19-22(20(32)11-15)17(3)23(34)24-26(4)13-21(33)37-30(25(35)28(19,24)6)27(26,5)7-8-29-12-16(2)9-18(36-29)14-31(29)30/h11,16-19,22,24H,7-10,12-14H2,1-6H3/t16-,17+,18+,19+,22?,24+,26-,27-,28?,29-,30?/m0/s1",CC1=CC(=O)C2[C@@H](C1)C1(C)C(=O)C34OC(=O)C[C@@](C)([C@H]1C(=O)[C@@H]2C)[C@]3(C)CC[C@]12C[C@@H](C)C[C@H](CN41)O2,C30H39NO6,,509.277737968,MXINPMPTHWBNPF,Alkaloids,Pseudoalkaloids,,Zoanthus,480145.0,['Eukaryota'],['Metazoa'],['Cnidaria'],['Anthozoa'],['Zoantharia'],['Zoanthidae'],['Unknown'],['Zoanthus'],['Unknown'],1,0,2.10573673248291 9250,329,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,FNYPZWBJPFEVFN-YLCGFITOSA-N,"InChI=1S/C23H29NO10/c1-2-14-15(6-5-13-4-3-7-24(10-13)8-9-25)16(21(30)31)12-32-22(14)34-23-20(29)19(28)18(27)17(11-26)33-23/h2-7,10,12,14-15,17-20,22-23,25-29H,1,8-9,11H2/b6-5+/t14-,15+,17-,18-,19+,20-,22+,23+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@H]1/C=C/c1ccc[n+](CCO)c1,C23H29NO10,pos_1_1proton1ethylamine,479.179146128,FNYPZWBJPFEVFN,Alkaloids,Nicotinic acid alkaloids,Pyridine alkaloids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9251,328,-1,,,,0.33760476,ISDB,NWAXYBAWVFTOMC-GODIQTDRSA-N,"InChI=1S/C23H34O6/c1-13-8-7-9-17-21(3,14(2)10-18(24)22(13,17)4)11-15-19(25)16(28-5)12-23(15,27)20(26)29-6/h12,14-15,17-18,24,27H,1,7-11H2,2-6H3/t14-,15?,17?,18+,21+,22+,23+/m1/s1",C=C1CCCC2[C@@]1(C)[C@@H](O)C[C@@H](C)[C@]2(C)CC1C(=O)C(OC)=C[C@@]1(O)C(=O)OC,C23H34O6,,406.235538808,NWAXYBAWVFTOMC,Terpenoids,Diterpenoids,,Dactylospongia elegans,165927.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Dictyoceratida'],['Thorectidae'],['Unknown'],['Dactylospongia'],['Dactylospongia elegans'],1,0,2.350419044494629 9252,328,-1,,,,0.33760476,ISDB,NWAXYBAWVFTOMC-GODIQTDRSA-N,"InChI=1S/C23H34O6/c1-13-8-7-9-17-21(3,14(2)10-18(24)22(13,17)4)11-15-19(25)16(28-5)12-23(15,27)20(26)29-6/h12,14-15,17-18,24,27H,1,7-11H2,2-6H3/t14-,15?,17?,18+,21+,22+,23+/m1/s1",C=C1CCCC2[C@@]1(C)[C@@H](O)C[C@@H](C)[C@]2(C)CC1C(=O)C(OC)=C[C@@]1(O)C(=O)OC,C23H34O6,,406.235538808,NWAXYBAWVFTOMC,Terpenoids,Diterpenoids,,Dactylospongia,165929.0,['Eukaryota'],['Metazoa'],['Porifera'],['Demospongiae'],['Dictyoceratida'],['Thorectidae'],['Unknown'],['Dactylospongia'],['Unknown'],1,0,2.350419044494629 9253,327,51,Polyketides,Linear polyketides,Acetogenins,0.30286038,ISDB,KCYRZEFVHDREPK-UHFFFAOYSA-N,"InChI=1S/C37H64O5/c1-3-4-5-6-7-13-16-19-22-31-33(40-31)24-26-35-36(42-35)27-25-34-32(41-34)23-20-17-14-11-9-8-10-12-15-18-21-30-28-29(2)39-37(30)38/h28-29,31-36H,3-27H2,1-2H3",CCCCCCCCCCC1OC1CCC1OC1CCC1OC1CCCCCCCCCCCCC1=CC(C)OC1=O,C37H64O5,,588.475375148,KCYRZEFVHDREPK,Polyketides,Linear polyketides,Acetogenins,Annona reticulata,94924.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona reticulata'],4,3,6.711441516876221 9254,327,51,Polyketides,Linear polyketides,Acetogenins,0.30286038,ISDB,KCYRZEFVHDREPK-RIFYHBPYSA-N,"InChI=1S/C37H64O5/c1-3-4-5-6-7-13-16-19-22-31-33(40-31)24-26-35-36(42-35)27-25-34-32(41-34)23-20-17-14-11-9-8-10-12-15-18-21-30-28-29(2)39-37(30)38/h28-29,31-36H,3-27H2,1-2H3/t29-,31-,32-,33-,34-,35+,36-/m1/s1",CCCCCCCCCC[C@H]1O[C@@H]1CC[C@@H]1O[C@@H]1CC[C@H]1O[C@@H]1CCCCCCCCCCCCC1=C[C@@H](C)OC1=O,C37H64O5,,588.475375148,KCYRZEFVHDREPK,Polyketides,Linear polyketides,Acetogenins,Annona rensoniana,321538.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona rensoniana'],4,3,6.711441516876221 9255,327,51,Polyketides,Linear polyketides,Acetogenins,0.30286038,ISDB,KCYRZEFVHDREPK-PVBUPMEXSA-N,"InChI=1S/C37H64O5/c1-3-4-5-6-7-13-16-19-22-31-33(40-31)24-26-35-36(42-35)27-25-34-32(41-34)23-20-17-14-11-9-8-10-12-15-18-21-30-28-29(2)39-37(30)38/h28-29,31-36H,3-27H2,1-2H3/t29-,31-,32+,33+,34-,35-,36+/m1/s1",CCCCCCCCCC[C@H]1O[C@H]1CC[C@H]1O[C@H]1CC[C@H]1O[C@H]1CCCCCCCCCCCCC1=C[C@@H](C)OC1=O,C37H64O5,,588.475375148,KCYRZEFVHDREPK,Polyketides,Linear polyketides,Acetogenins,Uvaria chamae,340656.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Uvarieae'],['Uvaria'],['Uvaria chamae'],4,3,6.711441516876221 9256,327,51,Polyketides,Linear polyketides,Acetogenins,0.30286038,ISDB,KCYRZEFVHDREPK-RIFYHBPYSA-N,"InChI=1S/C37H64O5/c1-3-4-5-6-7-13-16-19-22-31-33(40-31)24-26-35-36(42-35)27-25-34-32(41-34)23-20-17-14-11-9-8-10-12-15-18-21-30-28-29(2)39-37(30)38/h28-29,31-36H,3-27H2,1-2H3/t29-,31-,32-,33-,34-,35+,36-/m1/s1",CCCCCCCCCC[C@H]1O[C@@H]1CC[C@@H]1O[C@@H]1CC[C@H]1O[C@@H]1CCCCCCCCCCCCC1=C[C@@H](C)OC1=O,C37H64O5,,588.475375148,KCYRZEFVHDREPK,Polyketides,Linear polyketides,Acetogenins,Annona squamosa,915056.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Annoneae'],['Annona'],['Annona squamosa'],4,3,6.711441516876221 9257,322,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,OCNYGKNIVPVPPX-HWKANZROSA-N,"InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+",COC(=O)/C=C/c1ccc(O)c(O)c1,C10H10O4,pos_1_1proton,194.0579088,OCNYGKNIVPVPPX,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 9258,316,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.21323887,ISDB,PGYAYSRVSAJXTE-CLONMANBSA-N,"InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35-36(5,6)25-33(41)27-38(35,9)43)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-21,23-24,33-34,41-43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t22?,33-,34-,38+,39+,40-/m0/s1",C/C(C=C=C1C(C)(C)C[C@H](O)C[C@@]1(C)O)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C,C40H56O4,,600.417860272,PGYAYSRVSAJXTE,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",Trollius europaeus,805006.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius europaeus'],6,3,8.3529554605484 9259,315,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.4780856,ISDB,ZYEMGPIYFIJGTP-UHFFFAOYSA-N,"InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3",C=CCc1ccc(OC)c(OC)c1,C11H14O2,,178.099379688,ZYEMGPIYFIJGTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,3,9.412342429161072 9260,312,812,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.3981646,ISDB,OJTWEIFHVWJUKP-UHFFFAOYSA-N,"InChI=1S/C36H36O18/c37-13-22-26(42)29(45)32(48)36(52-22)54-34-28(44)25-20(40)11-19(12-21(25)51-33(34)16-4-8-18(39)9-5-16)50-35-31(47)30(46)27(43)23(53-35)14-49-24(41)10-3-15-1-6-17(38)7-2-15/h1-12,22-23,26-27,29-32,35-40,42-43,45-48H,13-14H2",O=C(C=Cc1ccc(O)cc1)OCC1OC(Oc2cc(O)c3c(=O)c(OC4OC(CO)C(O)C(O)C4O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O,C36H36O18,,756.190164312,OJTWEIFHVWJUKP,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum noveboracense,506026.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum columbianum'],6,3,9.092658400535583 9261,309,174,Terpenoids,Apocarotenoids,Megastigmanes,0.504476,ISDB,HNZUNIKWNYHEJJ-FMIVXFBMSA-N,"InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+",CC(=O)CC/C=C(\C)CCC=C(C)C,C13H22O,,194.167065324,HNZUNIKWNYHEJJ,Terpenoids,Apocarotenoids,Apocarotenoids (Ψ-),Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,2,10.017904043197632 9262,308,628,,,,0.31024876,ISDB,,,,,,,ZFCSBZMFLQFYRE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2409950494766235 9263,306,-1,,,,0.5878038,ISDB,IPUNBNMYMPOIEC-OAZVDXGHSA-N,"InChI=1S/C13H19NO7/c1-3-6-5(2)11(19)14(12(6)20)13-10(18)9(17)8(16)7(4-15)21-13/h7-10,13,15-18H,3-4H2,1-2H3/t7-,8-,9+,10-,13-/m1/s1",CCC1=C(C)C(=O)N([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O,C13H19NO7,,301.116151948,IPUNBNMYMPOIEC,,,,Staphylea bumalda,280397.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Crossosomatales'],['Staphyleaceae'],['Unknown'],['Staphylea'],['Staphylea bumalda'],4,0,6.351215124130249 9264,306,-1,,,,0.5878038,ISDB,IPUNBNMYMPOIEC-OAZVDXGHSA-N,"InChI=1S/C13H19NO7/c1-3-6-5(2)11(19)14(12(6)20)13-10(18)9(17)8(16)7(4-15)21-13/h7-10,13,15-18H,3-4H2,1-2H3/t7-,8-,9+,10-,13-/m1/s1",CCC1=C(C)C(=O)N([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O,C13H19NO7,,301.116151948,IPUNBNMYMPOIEC,,,,Garcinia mangostana,766177.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Clusiaceae'],['Garcinieae'],['Garcinia'],['Garcinia mangostana'],4,0,6.351215124130249 9265,304,-1,,,,0.4218633,ISDB,RGTONEMDTVVDMY-GRTPNEQMSA-N,"InChI=1S/C16H22O11/c1-2-6-7(3-10(18)19)8(14(23)24)5-25-15(6)27-16-13(22)12(21)11(20)9(4-17)26-16/h2,5-7,9,11-13,15-17,20-22H,1,3-4H2,(H,18,19)(H,23,24)/t6-,7+,9-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O)[C@H]1CC(=O)O,C16H22O11,,390.1162115239998,RGTONEMDTVVDMY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,8.687453150749207 9266,304,-1,,,,0.4218633,ISDB,RGTONEMDTVVDMY-CVJRUUBTSA-N,"InChI=1S/C16H22O11/c1-2-6-7(3-10(18)19)8(14(23)24)5-25-15(6)27-16-13(22)12(21)11(20)9(4-17)26-16/h2,5-7,9,11-13,15-17,20-22H,1,3-4H2,(H,18,19)(H,23,24)/t6-,7+,9+,11+,12-,13+,15+,16-/m1/s1",C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)OC=C(C(=O)O)[C@H]1CC(=O)O,C16H22O11,,390.1162115239998,RGTONEMDTVVDMY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,8.687453150749207 9267,304,-1,,,,0.4218633,ISDB,RGTONEMDTVVDMY-UHFFFAOYSA-N,"InChI=1S/C16H22O11/c1-2-6-7(3-10(18)19)8(14(23)24)5-25-15(6)27-16-13(22)12(21)11(20)9(4-17)26-16/h2,5-7,9,11-13,15-17,20-22H,1,3-4H2,(H,18,19)(H,23,24)",C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC(=O)O,C16H22O11,,390.116211524,RGTONEMDTVVDMY,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera,649885.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Unknown'],7,0,8.687453150749207 9268,303,162,,,,0.21422523,ISDB,,,,,,,BMNRKKFJIDDAOJ,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8569009304046631 9269,301,-1,,,,0.38368908,ISDB,NNUOUKPPTMCFQE-YHYXMXQVSA-N,"InChI=1S/C12H24N4O2/c1-10(9-17)5-8-16(12(13)14)7-4-3-6-15-11(2)18/h5,17H,3-4,6-9H2,1-2H3,(H3,13,14)(H,15,18)/b10-5-",CC(=O)NCCCCN(C/C=C(/C)CO)C(=N)N,C12H24N4O2,,256.189926008,NNUOUKPPTMCFQE,Alkaloids,Ornithine alkaloids,Polyamines,Galega orientalis,761640.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Galegeae'],['Galega'],['Galega orientalis'],4,0,5.534756302833557 9270,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,0,7.0 9271,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 9272,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 9273,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 9274,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,0,7.0 9275,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9276,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera periclymenum,811893.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera periclymenum'],7,0,7.0 9277,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 9278,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera tatarica,980069.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 9279,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 9280,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,0,7.0 9281,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,0,7.0 9282,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 9283,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9284,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,0,7.0 9285,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9286,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 9287,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 9288,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 9289,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9290,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,0,7.0 9291,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,0,7.0 9292,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,0,7.0 9293,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UHFFFAOYSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3",COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(O)C2C,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,0,7.0 9294,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera dioica,920862.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dioica'],7,0,7.0 9295,300,-1,,,,0.0,MS1_match,AMBQHHVBBHTQBF-UOUCRYGSSA-N,"InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1",COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C17H26O10,pos_1_1proton1acetonitrile,390.1525970319999,AMBQHHVBBHTQBF,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Lonicera korolkowii,692192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera korolkowii'],7,0,7.0 9296,298,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.41854113,ISDB,,,,,,,ATWJCCYPSOQNOE,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.6741645336151123 9297,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Flindersia maculosa,499504.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Flindersia'],['Flindersia maculosa'],4,3,6.797945499420166 9298,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Boenninghausenia albiflora,239188.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Boenninghausenia'],['Boenninghausenia albiflora'],4,3,6.797945499420166 9299,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Clausena anisum-olens,5233135.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Clausena'],['Clausena anisum-olens'],4,3,6.797945499420166 9300,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Hydrangea febrifuga,221379.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea febrifuga'],4,3,6.797945499420166 9301,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Xenophyllum ciliolatum,7610033.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Xenophyllum'],['Xenophyllum ciliolatum'],4,3,6.797945499420166 9302,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Zanthoxylum schinifolium,237365.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum schinifolium'],4,3,6.797945499420166 9303,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Citrus medica,798604.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Citrus'],['Citrus medica'],4,3,6.797945499420166 9304,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Hydrangea chinensis,486966.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea chinensis'],4,3,6.797945499420166 9305,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Hydrangea macrophylla,162001.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Cornales'],['Hydrangeaceae'],['Hydrangeeae'],['Hydrangea'],['Hydrangea macrophylla'],4,3,6.797945499420166 9306,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Daphne mezereum,912112.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malvales'],['Thymelaeaceae'],['Unknown'],['Daphne'],['Daphne mezereum'],4,3,6.797945499420166 9307,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia apiacea,119930.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia apiacea'],4,3,6.797945499420166 9308,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia carvifolia,846950.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia carvifolia'],4,3,6.797945499420166 9309,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Artemisia caruifolia,846950.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia carvifolia'],4,3,6.797945499420166 9310,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ayapana triplinervis,786810.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Eupatorieae'],['Ayapana'],['Ayapana triplinervis'],4,3,6.797945499420166 9311,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Zanthoxylum ailanthoides,806818.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Zanthoxylum'],['Zanthoxylum ailanthoides'],4,3,6.797945499420166 9312,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Flindersia dissosperma,1076073.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Flindersia'],['Flindersia dissosperma'],4,3,6.797945499420166 9313,297,356,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.32448637,ISDB,HAQWEMHXSIRYBE-UHFFFAOYSA-N,"InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3",COc1c(O)ccc2ccc(=O)oc12,C10H8O4,,192.042258736,HAQWEMHXSIRYBE,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Sinacalia tangutica,1010095.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Senecioneae'],['Sinacalia'],['Sinacalia tangutica'],4,3,6.797945499420166 9314,295,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.2432455,ISDB,VLEXYJYNPNSQRM-XRXBZNFBSA-N,"InChI=1S/C36H57NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-34(38)40-27-31(35(2,3)39)30-26-37-32-23-22-28(24-29(30)32)25-33-36(4,5)41-33/h13-14,22-24,26,31,33,37,39H,6-12,15-21,25,27H2,1-5H3/b14-13-/t31-,33+/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](c1c[nH]c2ccc(C[C@@H]3OC3(C)C)cc12)C(C)(C)O,C36H57NO4,,567.428759304,VLEXYJYNPNSQRM,,,,Hexalobus crispiflorus,6284.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Monodoreae'],['Hexalobus'],['Hexalobus crispiflorus'],4,0,4.9729819893836975 9315,289,-1,,,,0.0,MS1_match,ZVIQIPQKRVKNLN-GZMMTYOYSA-N,"InChI=1S/C12H16O7/c13-5-8(14)6-19-12(18)11(17)4-7-1-2-9(15)10(16)3-7/h1-3,8,11,13-17H,4-6H2/t8-,11+/m0/s1",O=C(OC[C@@H](O)CO)[C@H](O)Cc1ccc(O)c(O)c1,C12H16O7,pos_1_1proton1acetonitrile,272.089602852,ZVIQIPQKRVKNLN,Shikimates and Phenylpropanoids,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 9316,289,-1,,,,0.0,MS1_match,ZVIQIPQKRVKNLN-GZMMTYOYSA-N,"InChI=1S/C12H16O7/c13-5-8(14)6-19-12(18)11(17)4-7-1-2-9(15)10(16)3-7/h1-3,8,11,13-17H,4-6H2/t8-,11+/m0/s1",O=C(OC[C@@H](O)CO)[C@H](O)Cc1ccc(O)c(O)c1,C12H16O7,pos_1_1proton1acetonitrile,272.089602852,ZVIQIPQKRVKNLN,Shikimates and Phenylpropanoids,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 9317,284,476,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,NEVMWOQJRSZYIC-UUANRDTJSA-N,"InChI=1S/C30H36O18/c1-39-13-5-11-6-14(40-2)25(13)47-29-23(35)21(33)19(31)17(45-29)10-44-28(38)12-7-15(41-3)26(16(8-12)42-4)48-30-24(36)22(34)20(32)18(46-30)9-43-27(11)37/h5-8,17-24,29-36H,9-10H2,1-4H3/t17-,18-,19-,20-,21+,22+,23-,24-,29+,30+/m1/s1",COc1cc2cc(OC)c1O[C@@H]1O[C@H](COC(=O)c3cc(OC)c(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C30H36O18,pos_3_3proton,684.190164312,NEVMWOQJRSZYIC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 9318,283,213,Polyketides,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,ZBCYJHCFJNSGND-NGSPFIJSSA-N,"InChI=1S/C41H56N2O11/c1-8-30(45)54-32-24-18-25-31(32)39(53-10-3,19-27(24)49-5)41(48)34(51-7)33-38(16-15-28(50-6)40(25,33)37(41)42(9-2)20-38)21-52-36(47)23-13-11-12-14-26(23)43-29(44)17-22(4)35(43)46/h11-14,22,24-25,27-28,31-34,37,48H,8-10,15-21H2,1-7H3/t22-,24+,25+,27-,28-,31+,32-,33+,34-,37-,38-,39+,40-,41+/m0/s1",CCO[C@]12C[C@H](OC)[C@H]3C[C@H]([C@@H]1[C@H]3OC(=O)CC)[C@@]13[C@@H](OC)CC[C@@]4(COC(=O)c5ccccc5N5C(=O)C[C@H](C)C5=O)CN(CC)[C@@H]1[C@]2(O)[C@@H](OC)[C@H]43,C41H56N2O11,pos_2_2proton2acetonitrile,752.388410612,ZBCYJHCFJNSGND,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,3,7.5 9319,283,213,Polyketides,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,JOSBTZULDGZZRE-BHKLQMGOSA-N,"InChI=1S/C41H56N2O11/c1-8-21(3)35(46)54-31-24-17-25-30(31)39(48,18-27(24)50-5)41(49)33(52-7)32-38(15-14-28(51-6)40(25,32)37(41)42(9-2)19-38)20-53-36(47)23-12-10-11-13-26(23)43-29(44)16-22(4)34(43)45/h10-13,21-22,24-25,27-28,30-33,37,48-49H,8-9,14-20H2,1-7H3/t21-,22-,24+,25+,27-,28-,30+,31-,32+,33-,37-,38-,39+,40-,41-/m0/s1",CC[C@H](C)C(=O)O[C@H]1[C@@H]2C[C@@H]3[C@H]1[C@](O)(C[C@@H]2OC)[C@]1(O)[C@@H](OC)[C@@H]2[C@@]4(COC(=O)c5ccccc5N5C(=O)C[C@H](C)C5=O)CC[C@H](OC)[C@@]32[C@@H]1N(CC)C4,C41H56N2O11,pos_2_2proton2acetonitrile,752.388410612,JOSBTZULDGZZRE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium elatum,518362.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium elatum'],6,3,7.5 9320,282,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HEYZWPRKKUGDCR-QBXMEVCASA-N,"InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@]21O,C16H22O10,pos_1_1proton1ammonium,374.1212969039999,HEYZWPRKKUGDCR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,2,9.0 9321,282,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,HEYZWPRKKUGDCR-QBXMEVCASA-N,"InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@]21O,C16H22O10,pos_1_1proton1ammonium,374.1212969039999,HEYZWPRKKUGDCR,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,2,9.0 9322,282,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-GMHYLCIRSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)/t7?,8?,10-,11-,12+,13-,15+,16+/m1/s1",C=CC1C(CC=O)C(C(=O)O)=CO[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O10,pos_1_1proton1ammonium,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,2,9.0 9323,282,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,PUEUIRDVQIKCCG-GMHYLCIRSA-N,"InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)/t7?,8?,10-,11-,12+,13-,15+,16+/m1/s1",C=CC1C(CC=O)C(C(=O)O)=CO[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C16H22O10,pos_1_1proton1ammonium,374.1212969039999,PUEUIRDVQIKCCG,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],8,2,9.0 9324,281,-1,,,,0.0,MS1_match,XNIDEUYQVRRKJJ-FZPNTLRJSA-N,"InChI=1S/C35H34O18/c1-15(36)44-14-27-31(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(52-27)53-32-29(43)28-25(47-18(4)39)12-24(46-17(3)38)13-26(28)51-30(32)22-8-10-23(11-9-22)45-16(2)37/h8-13,27,31,33-35H,14H2,1-7H3/t27-,31-,33+,34-,35+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(OC(C)=O)cc3)oc3cc(OC(C)=O)cc(OC(C)=O)c3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C35H34O18,pos_3_1proton2sodium,742.1745142480002,XNIDEUYQVRRKJJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Staphisagria macrosperma,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 9325,281,-1,,,,0.0,MS1_match,XNIDEUYQVRRKJJ-FZPNTLRJSA-N,"InChI=1S/C35H34O18/c1-15(36)44-14-27-31(48-19(5)40)33(49-20(6)41)34(50-21(7)42)35(52-27)53-32-29(43)28-25(47-18(4)39)12-24(46-17(3)38)13-26(28)51-30(32)22-8-10-23(11-9-22)45-16(2)37/h8-13,27,31,33-35H,14H2,1-7H3/t27-,31-,33+,34-,35+/m1/s1",CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(OC(C)=O)cc3)oc3cc(OC(C)=O)cc(OC(C)=O)c3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C35H34O18,pos_3_1proton2sodium,742.1745142480002,XNIDEUYQVRRKJJ,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Delphinium staphisagria,969162.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Staphisagria'],['Staphisagria macrosperma'],6,0,6.0 9326,280,-1,,,,0.0,MS1_match,ILEDWLMCKZNDJK-UHFFFAOYSA-N,"InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H",O=c1ccc2cc(O)c(O)cc2o1,C9H6O4,pos_1_sodium,178.026608672,ILEDWLMCKZNDJK,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,0,6.0 9327,278,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.72362894,ISDB,WKQNRCYKYCKESD-YVHLTTHBSA-N,"InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3/b7-6-,10-9-,13-12-/t25-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H48NO7P,,517.316839506,WKQNRCYKYCKESD,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,8.394515752792358 9328,278,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.72362894,ISDB,WKQNRCYKYCKESD-UHFFFAOYSA-N,"InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)([O-])OCC[N+](C)(C)C,C26H48NO7P,,517.316839506,WKQNRCYKYCKESD,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.394515752792358 9329,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 9330,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 9331,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 9332,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 9333,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 9334,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-VHNBHZRZSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,0,6.0 9335,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 9336,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 9337,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 9338,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 9339,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 9340,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 9341,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum monticola,625485.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum monticola'],6,0,6.0 9342,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum campylorrhynchum,117075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum campylorrhynchum'],6,0,6.0 9343,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum pseudostapfianum,1073593.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum tuguancunense'],6,0,6.0 9344,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3",CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4C1C2O,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum piepunense,384357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum piepunense'],6,0,6.0 9345,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-IZGTZTBCSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13+,14+,15-,16-,17-,18+,19-,20+,21-,22-/m0/s1",CCN1C[C@@H]2CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum toxicum,5737811.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum toxicum'],6,0,6.0 9346,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum contortum,909683.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum contortum'],6,0,6.0 9347,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,UIVVIYORXDFKKO-IGWUHLPXSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)6-5-16(25)22-14(19)9-13(17(22)23)20-7-4-12(8-15(20)22)21(27,11-24)18(20)26/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]12CC[C@@H](C[C@H]14)[C@@](O)(CO)[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,UIVVIYORXDFKKO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 9348,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,UIVVIYORXDFKKO-IGWUHLPXSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)6-5-16(25)22-14(19)9-13(17(22)23)20-7-4-12(8-15(20)22)21(27,11-24)18(20)26/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]12CC[C@@H](C[C@H]14)[C@@](O)(CO)[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,UIVVIYORXDFKKO,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 9349,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,KEXOMXFRKYKFSR-UNIHHUBBSA-N,"InChI=1S/C22H35NO4/c1-3-23-10-19(2)14-9-13-17(23)21(14,7-5-16(19)25)15-8-12-4-6-20(13,15)18(26)22(12,27)11-24/h12-18,24-27H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18-,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)[C@H](O)CC[C@@]34[C@@H]5C[C@@H]6CC[C@]5([C@H](O)[C@]6(O)CO)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566086,KEXOMXFRKYKFSR,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum cochleare,7591220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum cochleare'],6,0,6.0 9350,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,VCOQRRVEIUTMFC-OVENPUKKSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-11-5-6-17(27-3)22-13(11)8-15(20(22)23)21(25)9-16(26-2)12-7-14(22)18(21)19(12)24/h11-20,24-25H,4-10H2,1-3H3/t11-,12+,13?,14?,15?,16-,17?,18?,19?,20+,21-,22?/m0/s1",CCN1C[C@@H]2CCC(OC)C34C5C[C@H]6C(O)C5[C@](O)(C[C@@H]6OC)C(CC23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566086,VCOQRRVEIUTMFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum forrestii,556432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum forrestii'],6,0,6.0 9351,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKGMHDMSESOCGT-YISBXEQFSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(27-3)22-12-7-11-14(24)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14-,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@H]6O)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566086,HKGMHDMSESOCGT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum geniculatum,97187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum geniculatum'],6,0,6.0 9352,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 9353,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,0,6.0 9354,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-DSGMTPGBSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 9355,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium poltaratzkii,6131764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium poltaratzkii'],6,0,6.0 9356,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 9357,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum soongaricum,5143682.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum soongaricum'],6,0,6.0 9358,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 9359,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kusnezoffii,141633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kusnezoffii'],6,0,6.0 9360,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaeli,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 9361,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 9362,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 9363,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium bicolor,591163.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium bicolor'],6,0,6.0 9364,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 9365,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-VHNBHZRZSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium davisii,6131635.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium davisii'],6,0,6.0 9366,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium nuttallianum,643524.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium nuttallianum'],6,0,6.0 9367,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum vilmorinianum,976183.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum vilmorinianum'],6,0,6.0 9368,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum napellus,586780.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum napellus'],6,0,6.0 9369,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 9370,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium pentagynum,782529.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium pentagynum'],6,0,6.0 9371,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-DSGMTPGBSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20-,21+,22-/m1/s1",CCN1C[C@@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum karakolicum,44345.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum karakolicum'],6,0,6.0 9372,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-ZRNHKMHYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13?,14+,15-,16+,17-,18+,19?,20+,21+,22?/m1/s1",CCN1C[C@]2(C)CC[C@H](O)C34C1C(C[C@@H]32)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium poltaratzkii,6131764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium poltaratzkii'],6,0,6.0 9373,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-JEJCSOMWSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1",CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14,C22H35NO4,pos_2MHNH3,377.2566085999999,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum variegatum,586783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum variegatum'],6,0,6.0 9374,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,HKQZUYOVMYOFIT-UHFFFAOYSA-N,"InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3",CCN1CC2(C)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O,C22H35NO4,pos_2MHNH3,377.2566086,HKQZUYOVMYOFIT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum carmichaelii,549536.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum carmichaelii'],6,0,6.0 9375,276,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,MDCQBGQVDRLEGB-SZDRHTRBSA-N,"InChI=1S/C22H35NO4/c1-4-23-11-19(2)7-6-15(27-3)22-14(19)9-13(18(22)23)20(25)8-5-12-10-21(22,26)17(20)16(12)24/h12-18,24-26H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,17+,18+,19-,20-,21-,22-/m0/s1",CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)CC[C@H]2C[C@]4(O)[C@@H]1[C@H]2O,C22H35NO4,pos_2MHNH3,377.2566086,MDCQBGQVDRLEGB,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 9376,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,3,7.5 9377,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_sodium,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 9378,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_sodium,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,3,7.5 9379,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_sodium,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 9380,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_sodium,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,3,7.5 9381,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_sodium,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,7.5 9382,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,pos_1_sodium,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,3,7.5 9383,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-TZYVJGCXSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17+,18-,19+,21-/m0/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,3,7.5 9384,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,3,7.5 9385,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,3,7.5 9386,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,3,7.5 9387,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,3,7.5 9388,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2",O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius macropetalus,230029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius macropetalus'],6,3,7.5 9389,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-TZYVJGCXSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17+,18-,19+,21-/m0/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,3,7.5 9390,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,3,7.5 9391,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,3,7.5 9392,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,3,7.5 9393,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,3,7.5 9394,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,3,7.5 9395,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2",O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius macropetalus,230029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius macropetalus'],6,3,7.5 9396,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-TZYVJGCXSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17+,18-,19+,21-/m0/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus japonicus,140131.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus japonicus'],6,3,7.5 9397,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,3,7.5 9398,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius chinensis,877307.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius chinensis'],6,3,7.5 9399,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum dasycarpum,421841.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum dasycarpum'],6,3,7.5 9400,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus ficaria,829312.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ficaria'],['Ficaria verna'],6,3,7.5 9401,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-VPRICQMDSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.1056468399998,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius ledebouri,841872.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius ledebouri'],6,3,7.5 9402,275,483,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.0,MS1_match,SGEWCQFRYRRZDC-UHFFFAOYSA-N,"InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2",O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)cc(O)c12,C21H20O10,pos_1_sodium,432.10564684,SGEWCQFRYRRZDC,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Trollius macropetalus,230029.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Adonideae'],['Trollius'],['Trollius macropetalus'],6,3,7.5 9403,273,-1,,,,0.0,MS1_match,PBLWZMSRSJTRHJ-NCIRKIHRSA-N,"InChI=1S/C32H44O16/c1-42-20-8-14(3-5-18(20)45-31-28(40)26(38)24(36)22(11-34)47-31)7-16-13-44-30(17(16)10-33)15-4-6-19(21(9-15)43-2)46-32-29(41)27(39)25(37)23(12-35)48-32/h3-6,8-9,16-17,22-41H,7,10-13H2,1-2H3/t16-,17-,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H44O16,pos_1_sodium,684.262935328,PBLWZMSRSJTRHJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 9404,267,-1,,,,0.0,MS1_match,ZYEMGPIYFIJGTP-UHFFFAOYSA-N,"InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3",C=CCc1ccc(OC)c(OC)c1,C11H14O2,pos_1_1proton1acetonitrile,178.099379688,ZYEMGPIYFIJGTP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Morina persica,326553.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Morina'],['Morina persica'],6,0,6.0 9405,267,-1,,,,0.0,MS1_match,VEPJYMZVLHBTJT-ONOSFVFSSA-N,"InChI=1S/C11H14O2/c1-7-3-2-4-8-9(12)5-6-10(13)11(7)8/h4-7,10-11,13H,2-3H2,1H3/t7-,10-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)C=C[C@@H](O)[C@H]21,C11H14O2,pos_1_1proton1acetonitrile,178.099379688,VEPJYMZVLHBTJT,Terpenoids,,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 9406,264,-1,,,,0.5694044,ISDB,BEKKBGJECYLADF-UHFFFAOYSA-N,"InChI=1S/C26H28O6/c1-26(2)8-4-5-15-13-31-22-12-20(29)24-19(28)11-21(32-25(24)16(22)10-17(15)26)14-6-7-18(27)23(9-14)30-3/h6-7,9,11-12,15,17,27,29H,4-5,8,10,13H2,1-3H3",COc1cc(-c2cc(=O)c3c(O)cc4c(c3o2)CC2C(CCCC2(C)C)CO4)ccc1O,C26H28O6,,436.188588616,BEKKBGJECYLADF,Shikimates and Phenylpropanoids,Isoflavonoids,Isoflavones,Helminthostachys zeylanica,178177.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Polypodiopsida'],['Ophioglossales'],['Ophioglossaceae'],['Unknown'],['Helminthostachys'],['Helminthostachys zeylanica'],0,0,2.2776176929473877 9407,261,700,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,YUTFBICAYRWLGQ-UHFFFAOYSA-N,"InChI=1S/C11H14O4/c1-13-10(12)8-4-6-9(7-5-8)11(14-2)15-3/h4-7,11H,1-3H3",COC(=O)c1ccc(C(OC)OC)cc1,C11H14O4,pos_1_sodium,210.089208928,YUTFBICAYRWLGQ,Shikimates and Phenylpropanoids,,,Aconitum lethale,6131432.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum lethale'],6,0,6.0 9408,261,700,Amino acids and Peptides,Small peptides,Dipeptides,0.0,MS1_match,YUTFBICAYRWLGQ-UHFFFAOYSA-N,"InChI=1S/C11H14O4/c1-13-10(12)8-4-6-9(7-5-8)11(14-2)15-3/h4-7,11H,1-3H3",COC(=O)c1ccc(C(OC)OC)cc1,C11H14O4,pos_1_sodium,210.089208928,YUTFBICAYRWLGQ,Shikimates and Phenylpropanoids,,,Aconitum falconeri,6131385.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum falconeri'],6,0,6.0 9409,259,-1,,,,0.0,MS1_match,RFTKPXQZIVKVOP-PMQCXRHVSA-N,"InChI=1S/C16H20O9/c1-23-10-4-2-8(6-9(10)18)3-5-12(19)25-16-15(22)14(21)13(20)11(7-17)24-16/h2-6,11,13-18,20-22H,7H2,1H3/b5-3+/t11-,13-,14+,15-,16+/m1/s1",COc1ccc(/C=C/C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C16H20O9,pos_1_1proton1ammonium,356.11073222,RFTKPXQZIVKVOP,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Actaea racemosa,512702.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea racemosa'],6,0,6.0 9410,258,171,Terpenoids,Sesquiterpenoids,Wax monoesters,0.0,MS1_match,VNRZCPPHNPEBFC-BKAPFMHSSA-N,"InChI=1S/C32H46N2O9/c1-6-34-15-28(16-43-26(35)17-9-7-8-10-19(17)33)12-11-21(40-3)31-24(28)25(42-5)32(38,27(31)34)30(37)14-20(39-2)18-13-29(31,36)23(30)22(18)41-4/h7-10,18,20-25,27,36-38H,6,11-16,33H2,1-5H3/t18-,20+,21+,22+,23+,24-,25+,27+,28+,29+,30-,31-,32-/m1/s1",CCN1C[C@]2(COC(=O)c3ccccc3N)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@@](O)([C@@H]13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC,C32H46N2O9,pos_2_1proton1potassium,602.320331052,VNRZCPPHNPEBFC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium glaucescens,70143.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium glaucescens'],6,0,6.0 9411,257,263,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Simple coumarins,0.3179777,ISDB,RSEGMZMZRFXVDC-OCCSQVGLSA-N,"InChI=1S/C16H16N2O4/c19-8-14(22)12(20)7-13(21)16-15-10(5-6-17-16)9-3-1-2-4-11(9)18-15/h1-6,12,14,18-20,22H,7-8H2/t12-,14+/m1/s1",O=C(C[C@@H](O)[C@@H](O)CO)c1nccc2c1[nH]c1ccccc12,C16H16N2O4,,300.111006992,RSEGMZMZRFXVDC,Alkaloids,Tryptophan alkaloids,Carboline alkaloids,Crocus sativus,542824.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Iridaceae'],['Croceae'],['Crocus'],['Crocus sativus'],4,2,6.271910786628723 9412,256,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.2907337,ISDB,KNARYUCFPVYOGC-UHFFFAOYSA-N,"InChI=1S/C40H77NO10/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-28-35(45)41-32(30-50-40-39(49)38(48)37(47)34(29-42)51-40)36(46)33(44)27-23-19-17-18-22-26-31(43)25-21-8-6-4-2/h11-12,31-34,36-40,42-44,46-49H,3-10,13-30H2,1-2H3,(H,41,45)",CCCCCCC=CCCCCCCCC(=O)NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCC(O)CCCCCC,C40H77NO10,,731.554747664,KNARYUCFPVYOGC,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Symphyotrichum subulatum,965961.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Symphyotrichum'],['Symphyotrichum subulatum'],4,3,6.66293478012085 9413,256,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.2907337,ISDB,KNARYUCFPVYOGC-RILHEVMBSA-N,"InChI=1S/C40H77NO10/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-28-35(45)41-32(30-50-40-39(49)38(48)37(47)34(29-42)51-40)36(46)33(44)27-23-19-17-18-22-26-31(43)25-21-8-6-4-2/h11-12,31-34,36-40,42-44,46-49H,3-10,13-30H2,1-2H3,(H,41,45)/b12-11+/t31-,32-,33-,34-,36+,37-,38+,39-,40-/m1/s1",CCCCCC/C=C/CCCCCCCC(=O)N[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCC[C@H](O)CCCCCC,C40H77NO10,,731.554747664,KNARYUCFPVYOGC,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Erigeron bonariensis,747355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Conyza'],['Conyza bonariensis'],4,3,6.66293478012085 9414,256,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.2907337,ISDB,KNARYUCFPVYOGC-RILHEVMBSA-N,"InChI=1S/C40H77NO10/c1-3-5-7-9-10-11-12-13-14-15-16-20-24-28-35(45)41-32(30-50-40-39(49)38(48)37(47)34(29-42)51-40)36(46)33(44)27-23-19-17-18-22-26-31(43)25-21-8-6-4-2/h11-12,31-34,36-40,42-44,46-49H,3-10,13-30H2,1-2H3,(H,41,45)/b12-11+/t31-,32-,33-,34-,36+,37-,38+,39-,40-/m1/s1",CCCCCC/C=C/CCCCCCCC(=O)N[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCC[C@H](O)CCCCCC,C40H77NO10,,731.554747664,KNARYUCFPVYOGC,Fatty acids,Sphingolipids,Neutral glycosphingolipids,Conyza bonariensis,747355.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Conyza'],['Conyza bonariensis'],4,3,6.66293478012085 9415,255,-1,,,,0.7434013,ISDB,CKPBBEOJHAPPBT-UHFFFAOYSA-N,"InChI=1S/C21H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(24)29-20(18-23)19-28-30(25,26)27-17-16-22/h20,23H,2-19,22H2,1H3,(H,25,26)",CCCCCCCCCCCCCCCC(=O)OC(CO)COP(=O)(O)OCCN,C21H44NO7P,,453.2855393779999,CKPBBEOJHAPPBT,Fatty acids,Glycerophospholipids,Glycerophosphoethanolamines,Asparagus officinalis,748359.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Asparagaceae'],['Unknown'],['Asparagus'],['Asparagus officinalis'],4,0,6.973605155944824 9416,252,618,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HTKODPPFQUGBMU-GQJRUFTLSA-N,"InChI=1S/C19H30O8/c1-9(20)25-11-7-8-17(5,24)19-14(22)12(16(3,4)27-19)13(26-10(2)21)15(23)18(11,19)6/h11-15,22-24H,7-8H2,1-6H3/t11-,12+,13-,14+,15-,17-,18-,19-/m0/s1",CC(=O)O[C@H]1[C@@H]2[C@@H](O)[C@@]3(OC2(C)C)[C@@](C)([C@@H](OC(C)=O)CC[C@]3(C)O)[C@H]1O,C19H30O8,pos_1_minus1proton2sodium,386.1940679199999,HTKODPPFQUGBMU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicolus,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,3,7.5 9417,252,618,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,0.0,MS1_match,HTKODPPFQUGBMU-GQJRUFTLSA-N,"InChI=1S/C19H30O8/c1-9(20)25-11-7-8-17(5,24)19-14(22)12(16(3,4)27-19)13(26-10(2)21)15(23)18(11,19)6/h11-15,22-24H,7-8H2,1-6H3/t11-,12+,13-,14+,15-,17-,18-,19-/m0/s1",CC(=O)O[C@H]1[C@@H]2[C@@H](O)[C@@]3(OC2(C)C)[C@@](C)([C@@H](OC(C)=O)CC[C@]3(C)O)[C@H]1O,C19H30O8,pos_1_minus1proton2sodium,386.1940679199999,HTKODPPFQUGBMU,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus vulcanicola,458835.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus vulcanicola'],6,3,7.5 9418,249,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_1proton,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 9419,249,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_1proton,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,3,9.5 9420,249,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_1proton,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 9421,249,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_1proton,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,3,9.5 9422,249,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_1proton,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 9423,249,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,DUBCCGAQYVUYEU-ZUGPOPFOSA-N,"InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1",O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C21H18O13,pos_1_1proton,478.0747406359998,DUBCCGAQYVUYEU,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,3,9.5 9424,247,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.7919946,ISDB,ZCCLDKGWJIREQF-PDBXOOCHSA-N,"InChI=1S/C21H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h3-4,6-7,9-10,20,22-23H,2,5,8,11-19H2,1H3/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO,C21H36O4,,352.261359632,ZCCLDKGWJIREQF,Fatty acids,Glycerolipids,Monoacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,3,8.667978286743164 9425,240,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.0,MS1_match,IPCSVZSSVZVIGE-UHFFFAOYSA-N,"InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)",CCCCCCCCCCCCCCCC(=O)O,C16H32O2,pos_2MHCH3CN,256.240230264,IPCSVZSSVZVIGE,Fatty acids,Fatty Acids and Conjugates,Branched fatty acids,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,1,8.5 9426,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 9427,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9428,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9429,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 9430,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 9431,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 9432,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 9433,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 9434,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 9435,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 9436,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 9437,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9438,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 9439,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 9440,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 9441,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9442,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_sodium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9443,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_sodium,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 9444,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_sodium,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9445,239,342,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_sodium,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 9446,237,548,,,,0.23745094,ISDB,,,,,,,ACQDTADHVBZARB,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9498037695884705 9447,236,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_1_1potassium,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 9448,233,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_2_2sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,1,8.5 9449,233,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_2_2sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,1,8.5 9450,233,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_2_2sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,1,8.5 9451,233,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_2_2sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,1,8.5 9452,233,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_2_2sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,1,8.5 9453,233,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_2_2sodium,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis koreana,3945134.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis koreana'],8,1,8.5 9454,232,-1,,,,0.20481864,ISDB,,,,,,,IGOSTOCJEXIQIA,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.8192745447158813 9455,231,-1,,,,0.0,MS1_match,NIOBQZWSLRPLTA-SJBHKMHNSA-N,"InChI=1S/C40H64O11/c1-35(2)14-16-40(34(46)47)17-15-38(6)21(22(40)18-35)8-9-26-37(5)12-11-27(36(3,4)25(37)10-13-39(26,38)7)50-33-31(29(44)24(42)20-49-33)51-32-30(45)28(43)23(41)19-48-32/h8,22-33,41-45H,9-20H2,1-7H3,(H,46,47)/t22-,23-,24+,25+,26-,27+,28+,29+,30-,31-,32+,33+,37+,38-,39-,40+/m1/s1",CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]2C1,C40H64O11,pos_1_sodium,720.444862868,NIOBQZWSLRPLTA,Terpenoids,Triterpenoids,Oleanane triterpenoids,Clematis chinensis,841986.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis chinensis'],9,0,9.0 9456,227,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.37926304,ISDB,,,,,,,BKPBDNJGYXIRBK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.517052173614502 9457,224,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.62237036,ISDB,,,,,,,PGXBELQFNRPKBC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.4894814491271973 9458,223,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.7973244,ISDB,ZCCLDKGWJIREQF-PDBXOOCHSA-N,"InChI=1S/C21H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h3-4,6-7,9-10,20,22-23H,2,5,8,11-19H2,1H3/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO,C21H36O4,,352.261359632,ZCCLDKGWJIREQF,Fatty acids,Glycerolipids,Monoacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,3,8.689297676086426 9459,221,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1potassium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9460,221,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1potassium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9461,221,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1potassium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9462,221,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1potassium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9463,221,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1potassium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9464,221,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1potassium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9465,221,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1potassium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9466,221,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1potassium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9467,220,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.77503127,ISDB,ZCCLDKGWJIREQF-PDBXOOCHSA-N,"InChI=1S/C21H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h3-4,6-7,9-10,20,22-23H,2,5,8,11-19H2,1H3/b4-3-,7-6-,10-9-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO,C21H36O4,,352.261359632,ZCCLDKGWJIREQF,Fatty acids,Glycerolipids,Monoacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,3,8.600125074386597 9468,216,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.61071473,ISDB,YGZDWJVKOQPZDX-UHFFFAOYSA-N,"InChI=1S/C12H14O2/c1-7-3-4-10-8(2)5-9(12(13)14)6-11(7)10/h5-7H,3-4H2,1-2H3,(H,13,14)",Cc1cc(C(=O)O)cc2c1CCC2C,C12H14O2,,190.099379688,YGZDWJVKOQPZDX,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,Curcuma zedoaria,777750.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Zingiberales'],['Zingiberaceae'],['Unknown'],['Curcuma'],['Curcuma zedoaria'],4,2,7.442858934402466 9469,215,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.6345612,ISDB,CQKNELOTFUSOTP-HMTIOLNVSA-N,"InChI=1S/C18H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h10-11,16-18,20-22H,2-9,12-15,19H2,1H3/b11-10+/t16-,17+,18-/m0/s1",CCCCCCCCC/C=C/CCC[C@@H](O)[C@@H](O)[C@@H](N)CO,C18H37NO3,,315.277344044,CQKNELOTFUSOTP,Fatty acids,Sphingolipids,Sphingoid bases,Averrhoa bilimbi,829006.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Oxalidales'],['Oxalidaceae'],['Unknown'],['Averrhoa'],['Averrhoa bilimbi'],4,2,7.538244724273682 9470,215,62,Fatty acids,Sphingolipids,Neutral glycosphingolipids,0.6345612,ISDB,CQKNELOTFUSOTP-HMTIOLNVSA-N,"InChI=1S/C18H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h10-11,16-18,20-22H,2-9,12-15,19H2,1H3/b11-10+/t16-,17+,18-/m0/s1",CCCCCCCCC/C=C/CCC[C@@H](O)[C@@H](O)[C@@H](N)CO,C18H37NO3,,315.277344044,CQKNELOTFUSOTP,Fatty acids,Sphingolipids,Sphingoid bases,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,2,7.538244724273682 9471,214,583,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.0,MS1_match,ISDXMFLGMQJRBT-UHFFFAOYSA-N,"InChI=1S/C40H44N2O7/c1-26(2)31-16-17-40(25-46-35(43)21-28-10-6-5-7-11-28)34(48-38(45)30-13-9-19-42-24-30)20-27(3)14-15-33-39(4,49-33)22-32(36(31)40)47-37(44)29-12-8-18-41-23-29/h5-13,18-20,23-24,32-34,36H,14-17,21-22,25H2,1-4H3",CC1=CC(OC(=O)c2cccnc2)C2(COC(=O)Cc3ccccc3)CCC(=C(C)C)C2C(OC(=O)c2cccnc2)CC2(C)OC2CC1,C40H44N2O7,pos_2_2proton,664.314851748,ISDXMFLGMQJRBT,Terpenoids,Diterpenoids,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 9472,214,583,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.0,MS1_match,BSEREUYHFDTZAR-CYVCHDHYSA-N,"InChI=1S/C40H44N2O7/c1-26(2)31-17-18-40(25-46-35(43)28-11-7-6-8-12-28)33(47-36(44)29-13-9-19-41-23-29)21-27(3)15-16-32-38(4,49-32)22-34(39(31,40)5)48-37(45)30-14-10-20-42-24-30/h6-14,19-21,23-24,32-34H,15-18,22,25H2,1-5H3/b27-21+/t32-,33-,34+,38-,39+,40-/m0/s1",CC(C)=C1CC[C@]2(COC(=O)c3ccccc3)[C@@H](OC(=O)c3cccnc3)/C=C(\C)CC[C@@H]3O[C@@]3(C)C[C@@H](OC(=O)c3cccnc3)[C@@]12C,C40H44N2O7,pos_2_2proton,664.314851748,BSEREUYHFDTZAR,Terpenoids,Diterpenoids,,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,0,6.0 9473,214,583,Alkaloids,Tryptophan alkaloids,Simple indole alkaloids,0.0,MS1_match,BSEREUYHFDTZAR-CYVCHDHYSA-N,"InChI=1S/C40H44N2O7/c1-26(2)31-17-18-40(25-46-35(43)28-11-7-6-8-12-28)33(47-36(44)29-13-9-19-41-23-29)21-27(3)15-16-32-38(4,49-32)22-34(39(31,40)5)48-37(45)30-14-10-20-42-24-30/h6-14,19-21,23-24,32-34H,15-18,22,25H2,1-5H3/b27-21+/t32-,33-,34+,38-,39+,40-/m0/s1",CC(C)=C1CC[C@]2(COC(=O)c3ccccc3)[C@@H](OC(=O)c3cccnc3)/C=C(\C)CC[C@@H]3O[C@@]3(C)C[C@@H](OC(=O)c3cccnc3)[C@@]12C,C40H44N2O7,pos_2_2proton,664.314851748,BSEREUYHFDTZAR,Terpenoids,Diterpenoids,,Nigella glandulifera,5737891.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella glandulifera'],6,0,6.0 9474,207,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5276928,ISDB,XSAHNTUFQBWEMI-PUNDARRNSA-N,"InChI=1S/C38H58O11/c1-18(15-20(46-19(2)40)31-34(5,6)49-31)25-27(42)30(45)36(8)23-10-9-22-33(3,4)24(48-32-29(44)28(43)26(41)21(16-39)47-32)11-12-37(22)17-38(23,37)14-13-35(25,36)7/h10,18,20-22,24-26,28-32,39,41,43-45H,9,11-17H2,1-8H3/t18-,20-,21-,22+,24+,25+,26+,28+,29-,30+,31+,32+,35-,36-,37-,38+/m1/s1",CC(=O)O[C@H](C[C@@H](C)[C@H]1C(=O)[C@H](O)[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C)[C@@H]1OC1(C)C,C38H58O11,,690.397912676,XSAHNTUFQBWEMI,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Actaea simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,2,9.110771179199219 9475,207,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.5276928,ISDB,XSAHNTUFQBWEMI-PUNDARRNSA-N,"InChI=1S/C38H58O11/c1-18(15-20(46-19(2)40)31-34(5,6)49-31)25-27(42)30(45)36(8)23-10-9-22-33(3,4)24(48-32-29(44)28(43)26(41)21(16-39)47-32)11-12-37(22)17-38(23,37)14-13-35(25,36)7/h10,18,20-22,24-26,28-32,39,41,43-45H,9,11-17H2,1-8H3/t18-,20-,21-,22+,24+,25+,26+,28+,29-,30+,31+,32+,35-,36-,37-,38+/m1/s1",CC(=O)O[C@H](C[C@@H](C)[C@H]1C(=O)[C@H](O)[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C)[C@@H]1OC1(C)C,C38H58O11,,690.397912676,XSAHNTUFQBWEMI,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Cimicifuga simplex,512693.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea simplex'],6,2,9.110771179199219 9476,205,263,Shikimates and Phenylpropanoids,Tryptophan alkaloids,Simple coumarins,0.0,MS1_match,LCAADQKZOBZHRD-UHFFFAOYSA-N,"InChI=1S/C13H14O5/c1-7-12-8(15-2)6-11(14)18-9(12)5-10(16-3)13(7)17-4/h5-6H,1-4H3",COc1cc2oc(=O)cc(OC)c2c(C)c1OC,C13H14O5,pos_1_1proton2acetonitrile,250.084123548,LCAADQKZOBZHRD,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 9477,204,140,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,0.0,MS1_match,FJKROLUGYXJWQN-UHFFFAOYSA-N,"InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)",O=C(O)c1ccc(O)cc1,C7H6O3,pos_1_1proton,138.031694052,FJKROLUGYXJWQN,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Lonicera microphylla,980075.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera microphylla'],7,3,8.5 9478,202,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HRAKXIGVAPGHEW-XHHYMNQSSA-N,"InChI=1S/C21H36O10/c1-10(2)5-16(24)31-15-6-12(11(3)7-22)13(21(15,4)28)9-29-20-19(27)18(26)17(25)14(8-23)30-20/h10,12-15,17-20,22-23,25-28H,3,5-9H2,1-2,4H3/t12-,13+,14-,15+,17-,18+,19-,20-,21+/m1/s1",C=C(CO)[C@H]1C[C@H](OC(=O)CC(C)C)[C@@](C)(O)[C@H]1CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H36O10,pos_1_sodium,448.23084735199984,HRAKXIGVAPGHEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9479,202,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,HRAKXIGVAPGHEW-XHHYMNQSSA-N,"InChI=1S/C21H36O10/c1-10(2)5-16(24)31-15-6-12(11(3)7-22)13(21(15,4)28)9-29-20-19(27)18(26)17(25)14(8-23)30-20/h10,12-15,17-20,22-23,25-28H,3,5-9H2,1-2,4H3/t12-,13+,14-,15+,17-,18+,19-,20-,21+/m1/s1",C=C(CO)[C@H]1C[C@H](OC(=O)CC(C)C)[C@@](C)(O)[C@H]1CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H36O10,pos_1_sodium,448.23084735199984,HRAKXIGVAPGHEW,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9480,201,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.3318033,ISDB,OFKUJHJJCQCWLX-UWVXJICLSA-N,"InChI=1S/C47H72O12/c1-13-25(3)39(53)58-37-38(59-40(54)26(4)14-2)47(24-55-41-36(52)35(51)30(23-48)57-41)29(21-42(37,6)7)28-15-16-32-44(10)19-18-33(50)43(8,9)31(44)17-20-45(32,11)46(28,12)22-34(47)56-27(5)49/h13-15,29-38,41,48,50-52H,16-24H2,1-12H3/b25-13+,26-14+/t29-,30+,31-,32+,33-,34+,35-,36-,37-,38-,41+,44-,45+,46+,47-/m0/s1",C/C=C(\C)C(=O)O[C@H]1[C@H](OC(=O)/C(C)=C/C)[C@]2(CO[C@@H]3O[C@H](CO)[C@H](O)[C@@H]3O)[C@H](OC(C)=O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2CC1(C)C,C47H72O12,,828.502377744,OFKUJHJJCQCWLX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Planchonia careya,3901629.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Lecythidaceae'],['Unknown'],['Planchonia'],['Planchonia careya'],4,3,6.827213168144226 9481,199,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_sodium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus chinensis,162150.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus chinensis'],6,0,6.0 9482,199,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SUGOCCUAKZVLFE-SDTHRHJYSA-N,"InChI=1S/C19H28O10/c1-2-3-6-27-18(26)12(22)8-10-4-5-13(11(21)7-10)28-19-17(25)16(24)15(23)14(9-20)29-19/h4-5,7,12,14-17,19-25H,2-3,6,8-9H2,1H3/t12-,14-,15-,16+,17-,19-/m1/s1",CCCCOC(=O)[C@H](O)Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C19H28O10,pos_1_sodium,416.168247096,SUGOCCUAKZVLFE,,,,Ranunculus cantoniensis,118756.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus cantoniensis'],6,0,6.0 9483,198,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SFLJKERWIWKVDG-TVAJMVSCSA-N,"InChI=1S/C16H26O10/c1-15(22)7-5-24-14(21)16(2,23)6(7)3-9(15)26-13-12(20)11(19)10(18)8(4-17)25-13/h6-13,17-20,22-23H,3-5H2,1-2H3/t6-,7-,8+,9-,10+,11-,12+,13-,15-,16-/m0/s1",C[C@@]1(O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@H]2[C@@H]1COC(=O)[C@@]2(C)O,C16H26O10,pos_1_1proton1acetonitrile,378.152597032,SFLJKERWIWKVDG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Patrinia scabra,68239.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia scabra'],6,3,7.5 9484,197,216,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.22789995,ISDB,HKSWNVKSXBFJGZ-YMILTQATSA-N,"InChI=1S/C16H18O10/c17-4-11-13(21)14(22)15(23)16(26-11)24-5-7-3-9(20)12-8(19)1-6(18)2-10(12)25-7/h1-3,11,13-19,21-23H,4-5H2/t11-,13-,14+,15-,16-/m1/s1",O=c1cc(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)oc2cc(O)cc(O)c12,C16H18O10,,370.089996776,HKSWNVKSXBFJGZ,Polyketides,Chromanes,Chromones,Cnidium monnieri,993235.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Cnidium'],['Cnidium monnieri'],4,0,4.911599814891815 9485,195,382,Fatty acids,Fatty esters,Wax monoesters,0.517171,ISDB,QTNGLMWAVBOBLJ-RCFZRFIHSA-N,"InChI=1S/C23H41NO2/c1-14(24(4)5)16-8-9-17-15-6-7-19-21(26)20(25)11-13-23(19,3)18(15)10-12-22(16,17)2/h14-21,25-26H,6-13H2,1-5H3/t14-,15-,16+,17-,18-,19-,20-,21-,22+,23+/m0/s1",C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC[C@H]4[C@H](O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)N(C)C,C23H41NO2,,363.313729552,QTNGLMWAVBOBLJ,Terpenoids,Steroids,Pregnane steroids,Pachysandra terminalis,314708.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Buxales'],['Buxaceae'],['Unknown'],['Pachysandra'],['Pachysandra terminalis'],4,0,6.068684101104736 9486,195,382,Fatty acids,Fatty esters,Wax monoesters,0.517171,ISDB,QTNGLMWAVBOBLJ-RCFZRFIHSA-N,"InChI=1S/C23H41NO2/c1-14(24(4)5)16-8-9-17-15-6-7-19-21(26)20(25)11-13-23(19,3)18(15)10-12-22(16,17)2/h14-21,25-26H,6-13H2,1-5H3/t14-,15-,16+,17-,18-,19-,20-,21-,22+,23+/m0/s1",C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC[C@H]4[C@H](O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)N(C)C,C23H41NO2,,363.313729552,QTNGLMWAVBOBLJ,Terpenoids,Steroids,Pregnane steroids,Sarcococca ruscifolia,437379.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Buxales'],['Buxaceae'],['Unknown'],['Sarcococca'],['Sarcococca ruscifolia'],4,0,6.068684101104736 9487,195,382,Fatty acids,Fatty esters,Wax monoesters,0.517171,ISDB,QTNGLMWAVBOBLJ-RCFZRFIHSA-N,"InChI=1S/C23H41NO2/c1-14(24(4)5)16-8-9-17-15-6-7-19-21(26)20(25)11-13-23(19,3)18(15)10-12-22(16,17)2/h14-21,25-26H,6-13H2,1-5H3/t14-,15-,16+,17-,18-,19-,20-,21-,22+,23+/m0/s1",C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC[C@H]4[C@H](O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)N(C)C,C23H41NO2,,363.313729552,QTNGLMWAVBOBLJ,Terpenoids,Steroids,Pregnane steroids,Sarcococca hookeriana,1098650.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Buxales'],['Buxaceae'],['Unknown'],['Sarcococca'],['Sarcococca hookeriana'],4,0,6.068684101104736 9488,193,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.44606915,ISDB,IXGDAVSSYHYPJX-GNQOIDSESA-N,"InChI=1S/C51H78O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,23-26,29,31,39-41,44-52,55-60H,3-4,9-10,15-16,21-22,27-28,30,32-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC,C51H78O15,,930.534071796,IXGDAVSSYHYPJX,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Heterocapsa circularisquama,817277.0,['Eukaryota'],['Unknown'],['Unknown'],['Dinophyceae'],['Peridiniales'],['Unknown'],['Unknown'],['Heterocapsa'],['Heterocapsa circularisquama'],1,3,4.284276604652405 9489,192,1346,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.632899,ISDB,OVEAWSPZRGBTSS-UHFFFAOYSA-N,"InChI=1S/C14H14N2O5/c17-12(6-13(18)19)16-11(14(20)21)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)",O=C(O)CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O,C14H14N2O5,,290.090271548,OVEAWSPZRGBTSS,Amino acids and Peptides,Small peptides,Dipeptides,Solanum lycopersicum,378964.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum lycopersicum'],4,0,6.531595945358276 9490,192,1346,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.632899,ISDB,OVEAWSPZRGBTSS-NSHDSACASA-N,"InChI=1S/C14H14N2O5/c17-12(6-13(18)19)16-11(14(20)21)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)/t11-/m0/s1",O=C(O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,C14H14N2O5,,290.090271548,OVEAWSPZRGBTSS,Amino acids and Peptides,Small peptides,Dipeptides,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,0,6.531595945358276 9491,191,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.5736432,ISDB,HQPQTQQUHPFUOA-ZCPYHVQDSA-N,"InChI=1S/C27H36O2/c1-21(11-7-8-12-22(2)15-10-18-28)13-9-14-23(3)16-17-26-24(4)19-25(29)20-27(26,5)6/h7-18,25,29H,19-20H2,1-6H3/b8-7+,13-9+,15-10+,17-16+,21-11+,22-12+,23-14+/t25-/m1/s1",CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=O)C(C)(C)C[C@H](O)C1,C27H36O2,,392.271530392,HQPQTQQUHPFUOA,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,1,6.794572830200195 9492,190,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.41501215,ISDB,GTBFQOGSRWBGDY-UJHNSAFVSA-N,"InChI=1S/C27H34O/c1-24(2)21-11-13-27-15-14-25(3,18-27)12-10-22(27)26(21,4)17-20(23(24)28)16-19-8-6-5-7-9-19/h5-9,14-16,21-22H,10-13,17-18H2,1-4H3/b20-16+/t21-,22+,25-,26-,27+/m1/s1",CC1(C)C(=O)/C(=C/c2ccccc2)C[C@]2(C)[C@@H]1CC[C@@]13C=C[C@@](C)(CC[C@H]12)C3,C27H34O,,374.260965708,GTBFQOGSRWBGDY,Terpenoids,Diterpenoids,Beyerane diterpenoids,Androstachys johnsonii,510615.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Picrodendraceae'],['Unknown'],['Androstachys'],['Androstachys johnsonii'],4,1,6.160048604011536 9493,189,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,GJIZSYSMPFMNED-CKTIHQIMSA-N,"InChI=1S/C20H30O3/c1-7-11(2)18(22)23-15-9-8-12(3)20(6)13(15)10-14(21)16-17(20)19(16,4)5/h10-12,15-17H,7-9H2,1-6H3/t11-,12-,15-,16-,17+,20+/m1/s1",CC[C@@H](C)C(=O)O[C@@H]1CC[C@@H](C)[C@@]2(C)C1=CC(=O)[C@@H]1[C@H]2C1(C)C,C20H30O3,pos_1_1proton1methanol,318.21949482,GJIZSYSMPFMNED,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,2,7.0 9494,189,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,PTYVAENMFGJFCK-JZPXUEKVSA-N,"InChI=1S/C20H30O3/c1-11(2)9-16(22)23-15-8-7-12(3)20(6)13(15)10-14(21)17-18(20)19(17,4)5/h10-12,15,17-18H,7-9H2,1-6H3/t12-,15-,17-,18+,20+/m1/s1",CC(C)CC(=O)O[C@@H]1CC[C@@H](C)[C@@]2(C)C1=CC(=O)[C@@H]1[C@H]2C1(C)C,C20H30O3,pos_1_1proton1methanol,318.21949482,PTYVAENMFGJFCK,Terpenoids,Sesquiterpenoids,Aristolane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,2,7.0 9495,182,91,Terpenoids,Sesquiterpenoids,Cadinane sesquiterpenoids,0.5730057,ISDB,BYDQKMZEOZVIJM-ZGCJARKRSA-N,"InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,8-9H,7,10H2,1-4H3/b6-5-,12-9-",C/C=C\C=C1\C(C)=CCCC1(C)C,C13H20,,176.15650064,BYDQKMZEOZVIJM,Terpenoids,Apocarotenoids,Apocarotenoids (β-),Passiflora edulis,183517.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Passifloraceae'],['Unknown'],['Passiflora'],['Passiflora edulis'],4,1,6.792022705078125 9496,180,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_2MH,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 9497,179,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.5090773,ISDB,TZAXQHDIMDQXRD-YJQAKTFBSA-N,"InChI=1S/C19H22O5/c1-4-9-18-10-5-6-16(21)19(18,22)24-17(12(18)2)13-7-8-14(20)15(11-13)23-3/h4-8,11-12,17,20,22H,1,9-10H2,2-3H3/t12-,17+,18-,19-/m1/s1",C=CC[C@]12CC=CC(=O)[C@@]1(O)O[C@H](c1ccc(O)c(OC)c1)[C@H]2C,C19H22O5,,330.146723804,TZAXQHDIMDQXRD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Aniba ferrea,6025335.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Aniba'],['Aniba ferrea'],4,3,7.536309242248535 9498,177,298,Shikimates and Phenylpropanoids,Diphenyl ethers (DPEs),Fungal DPEs,0.22484882,ISDB,QJYQMNNRRRKXNK-UHFFFAOYSA-N,"InChI=1S/C18H18O8/c1-9-5-12(19)15(18(22)25-4)13(6-9)26-14-8-10(23-2)7-11(16(14)20)17(21)24-3/h5-8,19-20H,1-4H3",COC(=O)c1cc(OC)cc(Oc2cc(C)cc(O)c2C(=O)OC)c1O,C18H18O8,,362.100167536,QJYQMNNRRRKXNK,Polyketides,Diphenyl ethers (DPEs),Fungal DPEs,Pestalotiopsis,443192.0,['Eukaryota'],['Fungi'],['Ascomycota'],['Sordariomycetes'],['Xylariales'],['Amphisphaeriaceae'],['Unknown'],['Pestalotiopsis'],['Unknown'],1,3,3.3993952870368958 9499,175,-1,,,,0.0,MS1_match,ZAGGPLANHIGDAL-LIVJIHFKSA-N,"InChI=1S/C15H19NO10/c1-24-11(20)4-7(2-3-10(18)19)8(5-16)25-15-14(23)13(22)12(21)9(6-17)26-15/h2-3,9,12-15,17,21-23H,4,6H2,1H3,(H,18,19)/b3-2+,8-7+/t9-,12+,13+,14+,15-/m0/s1",COC(=O)CC(/C=C/C(=O)O)=C(\C#N)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C15H19NO10,pos_1_1proton1methanol,373.100895808,ZAGGPLANHIGDAL,,,,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 9500,175,-1,,,,0.0,MS1_match,ZAGGPLANHIGDAL-LIVJIHFKSA-N,"InChI=1S/C15H19NO10/c1-24-11(20)4-7(2-3-10(18)19)8(5-16)25-15-14(23)13(22)12(21)9(6-17)26-15/h2-3,9,12-15,17,21-23H,4,6H2,1H3,(H,18,19)/b3-2+,8-7+/t9-,12+,13+,14+,15-/m0/s1",COC(=O)CC(/C=C/C(=O)O)=C(\C#N)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C15H19NO10,pos_1_1proton1methanol,373.100895808,ZAGGPLANHIGDAL,,,,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 9501,174,-1,,,,0.0,MS1_match,FHCHSXPHLRBEBR-LBPRGKRZSA-N,"InChI=1S/C15H16O6/c1-15(2,19)12-4-8-10(21-12)5-11-13(14(8)18)9(17)3-7(6-16)20-11/h3,5,12,16,18-19H,4,6H2,1-2H3/t12-/m0/s1",CC(C)(O)[C@@H]1Cc2c(cc3oc(CO)cc(=O)c3c2O)O1,C15H16O6,pos_1_1proton1acetonitrile,292.094688232,FHCHSXPHLRBEBR,Polyketides,Chromanes,Chromones,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 9502,174,-1,,,,0.0,MS1_match,FHCHSXPHLRBEBR-LBPRGKRZSA-N,"InChI=1S/C15H16O6/c1-15(2,19)12-4-8-10(21-12)5-11-13(14(8)18)9(17)3-7(6-16)20-11/h3,5,12,16,18-19H,4,6H2,1-2H3/t12-/m0/s1",CC(C)(O)[C@@H]1Cc2c(cc3oc(CO)cc(=O)c3c2O)O1,C15H16O6,pos_1_1proton1acetonitrile,292.094688232,FHCHSXPHLRBEBR,Polyketides,Chromanes,Chromones,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 9503,174,-1,,,,0.0,MS1_match,YLSUOAXNFAMZNP-KRXBUXKQSA-N,"InChI=1S/C15H16O6/c1-8(6-16)2-3-10-11(18)5-13(20)14-12(19)4-9(7-17)21-15(10)14/h2,4-5,16-18,20H,3,6-7H2,1H3/b8-2+",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO,C15H16O6,pos_1_1proton1acetonitrile,292.094688232,YLSUOAXNFAMZNP,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 9504,174,-1,,,,0.0,MS1_match,YLSUOAXNFAMZNP-KRXBUXKQSA-N,"InChI=1S/C15H16O6/c1-8(6-16)2-3-10-11(18)5-13(20)14-12(19)4-9(7-17)21-15(10)14/h2,4-5,16-18,20H,3,6-7H2,1H3/b8-2+",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(CO)oc12)CO,C15H16O6,pos_1_1proton1acetonitrile,292.094688232,YLSUOAXNFAMZNP,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 9505,172,-1,,,,0.0,MS1_match,MUPFEKGTMRGPLJ-ZQSKZDJDSA-N,"InChI=1S/C18H32O16/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18/h5-17,19-29H,1-4H2/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16+,17-,18+/m1/s1",OC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C18H32O16,pos_1_1potassium,504.1690349439997,MUPFEKGTMRGPLJ,Carbohydrates,Saccharides,Disaccharides,Salacia oblonga,316027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia oblonga'],6,0,6.0 9506,172,-1,,,,0.0,MS1_match,MUPFEKGTMRGPLJ-ZQSKZDJDSA-N,"InChI=1S/C18H32O16/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18/h5-17,19-29H,1-4H2/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16+,17-,18+/m1/s1",OC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C18H32O16,pos_1_1potassium,504.1690349439997,MUPFEKGTMRGPLJ,Carbohydrates,Saccharides,Disaccharides,Salacia oblonga,316027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia oblonga'],6,0,6.0 9507,172,-1,,,,0.0,MS1_match,MUPFEKGTMRGPLJ-ZQSKZDJDSA-N,"InChI=1S/C18H32O16/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18/h5-17,19-29H,1-4H2/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16+,17-,18+/m1/s1",OC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C18H32O16,pos_1_1potassium,504.1690349439997,MUPFEKGTMRGPLJ,Carbohydrates,Saccharides,Disaccharides,Salacia oblonga,316027.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Salacia'],['Salacia oblonga'],6,0,6.0 9508,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,0,7.0 9509,171,-1,,,,0.0,MS1_match,CPYDMLXRLHYXSV-UNKAVFLYSA-N,"InChI=1S/C18H22O9/c1-25-13-7-10(3-5-11(13)19)4-6-15(21)27-14-9-18(24,17(23)26-2)8-12(20)16(14)22/h3-7,12,14,16,19-20,22,24H,8-9H2,1-2H3/b6-4+/t12-,14-,16-,18+/m0/s1",COC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(OC)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,CPYDMLXRLHYXSV,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9510,171,-1,,,,0.0,MS1_match,HPJJCRNQEWRFQW-ILXVDBEPSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(14(22)9-18)27-15(23)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-22,25H,2,8-9H2,1H3/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](O)[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,HPJJCRNQEWRFQW,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9511,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 9512,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,0,7.0 9513,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9514,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 9515,171,-1,,,,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9516,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera quinquelocularis,118025.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera quinquelocularis'],7,0,7.0 9517,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera morrowii,484242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera tatarica'],7,0,7.0 9518,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera angustifolia,6061340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera angustifolia'],7,0,7.0 9519,171,-1,,,,0.0,MS1_match,LEUHYTKFUDEERH-NBJMIBJLSA-N,"InChI=1S/C18H22O9/c1-2-26-17(24)18(25)8-13(21)16(23)14(9-18)27-15(22)6-4-10-3-5-11(19)12(20)7-10/h3-7,13-14,16,19-21,23,25H,2,8-9H2,1H3/b6-4+/t13-,14-,16-,18+/m0/s1",CCOC(=O)[C@]1(O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)C1,C18H22O9,pos_1_1proton1ammonium,382.126382284,LEUHYTKFUDEERH,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9520,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera caerulea,1086606.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera caerulea'],7,0,7.0 9521,171,-1,,,,0.0,MS1_match,VSJGJMKGNMDJCI-ZASXJUAOSA-N,"InChI=1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)OCC[C@H]21,C16H22O9,pos_1_1proton1acetonitrile,358.126382284,VSJGJMKGNMDJCI,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9522,170,59,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),0.41431364,ISDB,MLYOGKJJENFVJN-BTDICHCPSA-N,"InChI=1S/C13H18O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-7,12H,8H2,1-4H3/b6-5+/t12-/m1/s1",CC(=O)/C=C/[C@@H]1C(C)=CC(=O)CC1(C)C,C13H18O2,,206.130679816,MLYOGKJJENFVJN,Terpenoids,Apocarotenoids,Apocarotenoids(ε-),Viburnum dilatatum,205155.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Adoxaceae'],['Unknown'],['Viburnum'],['Viburnum dilatatum'],5,3,8.157254576683044 9523,168,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1ammonium,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 9524,168,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,NFUHNVZGHNEYRG-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)29)22(30)20(12-27)37-17-8-5-14(10-19(17)35-2)4-3-9-36-26-25(33)24(32)23(31)21(13-28)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OC)ccc1O,C26H36O12,pos_1_1proton1ammonium,540.2206765919998,NFUHNVZGHNEYRG,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 9525,168,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,VHHJRIJKJTYYIZ-GKRKWVKGSA-N,"InChI=1S/C26H36O12/c1-34-18-10-14(4-3-9-27)5-7-16(18)36-20(12-28)22(30)15-6-8-17(19(11-15)35-2)37-26-25(33)24(32)23(31)21(13-29)38-26/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21-,22+,23-,24+,25-,26-/m1/s1",COc1cc([C@H](O)[C@@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C26H36O12,pos_1_1proton1ammonium,540.220676592,VHHJRIJKJTYYIZ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 9526,168,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,HZYWTYSKPVTFNA-URGBZLTBSA-N,"InChI=1S/C26H36O12/c1-34-18-11-15(6-7-16(18)30)25(38-26-24(33)23(32)22(31)20(12-28)37-26)21(13-29)36-17-8-5-14(4-3-9-27)10-19(17)35-2/h5-8,10-11,20-33H,3-4,9,12-13H2,1-2H3/t20-,21+,22-,23+,24-,25+,26+/m1/s1",COc1cc([C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](CO)Oc2ccc(CCCO)cc2OC)ccc1O,C26H36O12,pos_1_1proton1ammonium,540.220676592,HZYWTYSKPVTFNA,Shikimates and Phenylpropanoids,Lignans,Neolignans,Lonicera gracilipes,920854.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera gracilipes'],7,3,8.5 9527,166,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 9528,166,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 9529,166,401,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,OVSQVDMCBVZWGM-LVWULRLVSA-N,"InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1",O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21H20O12,pos_1_1proton,464.09547608,OVSQVDMCBVZWGM,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,3,9.5 9530,165,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7728935,ISDB,HXQHFNIKBKZGRP-UHFFFAOYSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)",CCCCCC=CCC=CCCC=CCCCC(=O)O,C18H30O2,,278.2245802,HXQHFNIKBKZGRP,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Teucrium cubense,3882648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Teucrium'],['Teucrium cubense'],4,3,8.59157395362854 9531,165,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.7728935,ISDB,HXQHFNIKBKZGRP-UHFFFAOYSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)",CCCCCC=CCC=CCCC=CCCCC(=O)O,C18H30O2,,278.2245802,HXQHFNIKBKZGRP,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Teucrium depressum,3882648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Teucrium'],['Teucrium cubense'],4,3,8.59157395362854 9532,163,174,Terpenoids,Apocarotenoids,Megastigmanes,0.0,MS1_match,JDYWIMCSAUNOHC-OOLFRTMQSA-N,"InChI=1S/C47H80O18/c1-21(8-11-28(50)42(3,4)59)30-24(63-41-38(58)35(55)33(53)25(64-41)18-61-39-37(57)34(54)31(51)22(2)62-39)16-45(7)27-10-9-26-43(5,20-48)29(65-40-36(56)32(52)23(49)17-60-40)12-13-46(26)19-47(27,46)15-14-44(30,45)6/h21-41,48-59H,8-20H2,1-7H3/t21-,22+,23+,24+,25-,26+,27+,28+,29+,30?,31+,32+,33-,34-,35+,36-,37-,38-,39-,40+,41-,43-,44-,45+,46-,47+/m1/s1",C[C@H](CC[C@H](O)C(C)(C)O)C1[C@@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)C[C@@]2(C)[C@@H]3CC[C@H]4[C@@](C)(CO)[C@@H](O[C@@H]5OC[C@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C,C47H80O18,pos_2_1proton1sodium,932.53446572,JDYWIMCSAUNOHC,Terpenoids,Triterpenoids,Cycloartane triterpenoids,Thalictrum foetidum,98303.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum foetidum'],6,1,6.5 9533,159,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,BVEVSYQMQABMQM-UHFFFAOYSA-N,"InChI=1S/C21H36O11/c1-19(2)9-4-12(20(19,3)5-10(9)23)32-17-15(26)14(25)13(24)11(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-18,22-28H,4-8H2,1-3H3",CC1(C)C2CC(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C1(C)CC2O,C21H36O11,pos_1_1proton1ammonium,464.225761972,BVEVSYQMQABMQM,Terpenoids,Monoterpenoids,Camphane monoterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 9534,159,65,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SFDNWSCFCRWISC-GNMWDIMASA-N,"InChI=1S/C21H36O11/c1-19(2)10-4-5-20(3,32-19)12(6-10)31-17-15(25)14(24)13(23)11(30-17)7-28-18-16(26)21(27,8-22)9-29-18/h10-18,22-27H,4-9H2,1-3H3/t10-,11-,12+,13-,14+,15-,16+,17+,18-,20+,21-/m1/s1",CC1(C)O[C@@]2(C)CC[C@@H]1C[C@@H]2O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H36O11,pos_1_1proton1ammonium,464.225761972,SFDNWSCFCRWISC,Terpenoids,Monoterpenoids,Monocyclic monoterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,2,7.0 9535,158,462,Terpenoids,Steroids,Cholestane steroids,0.45504236,ISDB,DPKBLLFCUGWECD-GTYQNAEWSA-N,"InChI=1S/C28H46O3/c1-18-19(29)7-8-20-24(18,3)10-9-21-25(20,4)12-13-27(6)22-17-23(2,30)11-15-28(22,31)16-14-26(21,27)5/h18,20-22,30-31H,7-17H2,1-6H3/t18-,20+,21-,22-,23+,24+,25-,26+,27-,28-/m0/s1",C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@](C)(O)CC[C@]3(O)CC[C@]12C,C28H46O3,,430.344695332,DPKBLLFCUGWECD,Terpenoids,Triterpenoids,Friedelane triterpenoids,Euonymus laxiflorus,310705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Euonymus'],['Euonymus laxiflorus'],7,1,9.320169448852539 9536,157,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9537,157,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,BMRSEYFENKXDIS-OTCYKTEZSA-N,"InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O8,pos_1_1proton,338.1001675359999,BMRSEYFENKXDIS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9538,154,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.30769965,ISDB,KNFOHFRALRKTOJ-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc(C[C@@H]2CO[C@@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,10.230798602104187 9539,154,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.30769965,ISDB,KNFOHFRALRKTOJ-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,10.230798602104187 9540,153,-1,,,,0.0,MS1_match,PRCDDNKVZQBPNG-YBWZTWLNSA-N,"InChI=1S/C18H30O3/c1-11-9-14(20-12(2)19)15-17(11,5)10-13-7-8-18(15,6)21-16(13,3)4/h11,13-15H,7-10H2,1-6H3/t11-,13-,14-,15-,17-,18+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@@]2(C)C[C@H]3CC[C@](C)(OC3(C)C)[C@H]12,C18H30O3,pos_1_sodium,294.21949482,PRCDDNKVZQBPNG,Terpenoids,Sesquiterpenoids,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,0,6.0 9541,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia fasciculifera,633799.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia fasciculifera'],4,2,7.224661111831665 9542,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Virgilia oroboides,761236.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Podalyrieae'],['Virgilia'],['Virgilia oroboides'],4,2,7.224661111831665 9543,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Toxicodendron vernicifluum,350856.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Toxicodendron'],['Toxicodendron vernicifluum'],4,2,7.224661111831665 9544,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Solanum pseudocapsicum,121218.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Solaneae'],['Solanum'],['Solanum pseudocapsicum'],4,2,7.224661111831665 9545,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia pycnantha,39866.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia pycnantha'],4,2,7.224661111831665 9546,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia mearnsii,343265.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia mearnsii'],4,2,7.224661111831665 9547,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia neriifolia,618995.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia neriifolia'],4,2,7.224661111831665 9548,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia dealbata,274405.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia dealbata'],4,2,7.224661111831665 9549,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Baptisia lecontei,3928764.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Sophoreae'],['Baptisia'],['Baptisia lecontei'],4,2,7.224661111831665 9550,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia clunies-rossiae,3918081.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia clunies-rossiae'],4,2,7.224661111831665 9551,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia oshanesii,485960.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia oshanesii'],4,2,7.224661111831665 9552,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia mollifolia,882772.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia mollifolia'],4,2,7.224661111831665 9553,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia terminalis,485967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia terminalis'],4,2,7.224661111831665 9554,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia leucoclada,1081334.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia leucoclada'],4,2,7.224661111831665 9555,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia peuce,3918125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia peuce'],4,2,7.224661111831665 9556,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia crombiei,3918220.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia crombiei'],4,2,7.224661111831665 9557,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia saxatilis,3918435.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia saxatilis'],4,2,7.224661111831665 9558,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia filicifolia,1062329.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia filicifolia'],4,2,7.224661111831665 9559,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia buxifolia,3918242.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia buxifolia'],4,2,7.224661111831665 9560,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia binervata,997695.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia binervata'],4,2,7.224661111831665 9561,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia fimbriata,452614.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia fimbriata'],4,2,7.224661111831665 9562,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia constablei,1062325.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia constablei'],4,2,7.224661111831665 9563,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia calamifolia,867933.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia calamifolia'],4,2,7.224661111831665 9564,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia mabellae,1062323.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia mabellae'],4,2,7.224661111831665 9565,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia falciformis,867937.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia falciformis'],4,2,7.224661111831665 9566,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia kettlewelliae,3917832.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia kettlewelliae'],4,2,7.224661111831665 9567,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia cultriformis,1081327.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia cultriformis'],4,2,7.224661111831665 9568,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia irrorata,1062318.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia irrorata'],4,2,7.224661111831665 9569,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia rubida,3918444.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia rubida'],4,2,7.224661111831665 9570,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia silvestris,97456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia silvestris'],4,2,7.224661111831665 9571,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia cardiophylla,639796.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia cardiophylla'],4,2,7.224661111831665 9572,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia decora,3918328.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia decora'],4,2,7.224661111831665 9573,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia deanei,103860.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia deanei'],4,2,7.224661111831665 9574,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia lanigera,3917633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia lanigera'],4,2,7.224661111831665 9575,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia parramattensis,60602.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia parramattensis'],4,2,7.224661111831665 9576,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia trachyphloia,730413.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia trachyphloia'],4,2,7.224661111831665 9577,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia vestita,660545.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia vestita'],4,2,7.224661111831665 9578,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia elata,633797.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia elata'],4,2,7.224661111831665 9579,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia chrysotricha,3918470.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia chrysotricha'],4,2,7.224661111831665 9580,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-UHFFFAOYSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H",O=C1c2ccc(O)cc2OC(c2ccc(O)c(O)c2)C1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia carneorum,3918002.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia carneorum'],4,2,7.224661111831665 9581,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia adunca,33827.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia adunca'],4,2,7.224661111831665 9582,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Capsicum annuum,473836.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Capsiceae'],['Capsicum'],['Capsicum annuum'],4,2,7.224661111831665 9583,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Acacia baileyana,639792.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Acacieae'],['Acacia'],['Acacia baileyana'],4,2,7.224661111831665 9584,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Lawsonia inermis,996694.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Myrtales'],['Lythraceae'],['Unknown'],['Lawsonia'],['Lawsonia inermis'],4,2,7.224661111831665 9585,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Gleditsia japonica,787616.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Unknown'],['Gleditsia'],['Gleditsia japonica'],4,2,7.224661111831665 9586,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Brucea javanica,841359.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Simaroubaceae'],['Unknown'],['Brucea'],['Brucea javanica'],4,2,7.224661111831665 9587,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Prosopidastrum globosum,3918763.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Mimoseae'],['Prosopidastrum'],['Prosopidastrum globosum'],4,2,7.224661111831665 9588,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Rhus typhina,1010430.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Rhus'],['Rhus typhina'],4,2,7.224661111831665 9589,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Cotinus coggygria,876714.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Anacardiaceae'],['Unknown'],['Cotinus'],['Cotinus coggygria'],4,2,7.224661111831665 9590,150,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.5561653,ISDB,FNUPUYFWZXZMIE-LSDHHAIUSA-N,"InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1",O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C15H12O6,,288.063388104,FNUPUYFWZXZMIE,Shikimates and Phenylpropanoids,Flavonoids,Dihydroflavonols,Robinia pseudoacacia,928416.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Robinieae'],['Robinia'],['Robinia pseudoacacia'],4,2,7.224661111831665 9591,149,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,pos_1_1sodium1acetonitrile,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 9592,149,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,UYGYXBOUYJLANA-CCXSFMJYSA-N,"InChI=1S/C11H14O3/c1-6-4-7(12)5-8-9(13)2-3-10(14)11(6)8/h2-3,5-7,10-12,14H,4H2,1H3/t6-,7-,10-,11+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C=C[C@@H](O)[C@H]21,C11H14O3,pos_1_1sodium1acetonitrile,194.094294308,UYGYXBOUYJLANA,Terpenoids,,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 9593,148,216,Shikimates and Phenylpropanoids,Flavonoids,Iridoids monoterpenoids,0.0,MS1_match,YMZBVMSUANSVLO-MMGDPGAJSA-N,"InChI=1S/C48H56O27/c1-16-30(55)34(59)37(62)46(67-16)69-21-12-24(53)29-25(13-21)70-42(19-6-9-22(51)23(52)11-19)43(33(29)58)74-48-39(64)36(61)32(57)27(72-48)15-66-45-40(65)44(75-47-38(63)35(60)31(56)26(14-49)71-47)41(17(2)68-45)73-28(54)10-5-18-3-7-20(50)8-4-18/h3-13,16-17,26-27,30-32,34-41,44-53,55-57,59-65H,14-15H2,1-2H3/b10-5+/t16-,17-,26+,27+,30-,31+,32-,34+,35-,36-,37+,38+,39+,40+,41-,44-,45+,46-,47-,48-/m0/s1",C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](OC(=O)/C=C/c6ccc(O)cc6)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O,C48H56O27,pos_1_1proton,1064.3008965320005,YMZBVMSUANSVLO,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Aconitum anthora,14057.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum anthora'],6,2,7.0 9594,146,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_sodium,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 9595,146,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_sodium,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 9596,146,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_sodium,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea cimicifuga,988720.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea cimicifuga'],6,0,6.0 9597,146,-1,,,,0.0,MS1_match,YWJXCIXBAKGUKZ-HJJNZUOJSA-N,"InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1",COc1c(O)cc2c(c1O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC2=O,C14H16O9,pos_1_sodium,328.07943209199993,YWJXCIXBAKGUKZ,Shikimates and Phenylpropanoids,Coumarins,Isocoumarins,Actaea elata,988729.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea elata'],6,0,6.0 9598,145,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_1_sodium,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9599,145,-1,,,,0.0,MS1_match,SBLZVJIHPWRSQQ-UHFFFAOYSA-N,"InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3",COc1cc(C2Oc3c(OC)cc(CCCO)cc3C2CO)ccc1O,C20H24O6,pos_1_sodium,360.15728848799995,SBLZVJIHPWRSQQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,0,8.0 9600,140,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.39332914,ISDB,,,,,,,NSUHFZHIKMSXME,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.5733165740966797 9601,138,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.30798325,ISDB,QIVLWPIJESKEMW-JHJDZIRVSA-N,"InChI=1S/C37H60O5/c1-25(17-23-41-27(3)38)12-14-29-26(2)13-15-30-35(29,7)19-11-20-36(30,8)32(39)42-37(9)21-10-18-34(6)22-16-28(24-31(34)37)33(4,5)40/h17,28-31,40H,2,10-16,18-24H2,1,3-9H3/b25-17+/t28-,29+,30-,31-,34-,35-,36+,37-/m1/s1",C=C1CC[C@@H]2[C@](C)(CCC[C@]2(C)C(=O)O[C@]2(C)CCC[C@]3(C)CC[C@@H](C(C)(C)O)C[C@H]32)[C@H]1CC/C(C)=C/COC(C)=O,C37H60O5,,584.4440750199999,QIVLWPIJESKEMW,Terpenoids,Diterpenoids,Labdane diterpenoids,Pinalia japonica,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,0,5.231932997703552 9602,138,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.30798325,ISDB,QIVLWPIJESKEMW-JHJDZIRVSA-N,"InChI=1S/C37H60O5/c1-25(17-23-41-27(3)38)12-14-29-26(2)13-15-30-35(29,7)19-11-20-36(30,8)32(39)42-37(9)21-10-18-34(6)22-16-28(24-31(34)37)33(4,5)40/h17,28-31,40H,2,10-16,18-24H2,1,3-9H3/b25-17+/t28-,29+,30-,31-,34-,35-,36+,37-/m1/s1",C=C1CC[C@@H]2[C@](C)(CCC[C@]2(C)C(=O)O[C@]2(C)CCC[C@]3(C)CC[C@@H](C(C)(C)O)C[C@H]32)[C@H]1CC/C(C)=C/COC(C)=O,C37H60O5,,584.4440750199999,QIVLWPIJESKEMW,Terpenoids,Diterpenoids,Labdane diterpenoids,Conchidium japonicum,3979206.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asparagales'],['Orchidaceae'],['Podochileae'],['Conchidium'],['Conchidium japonicum'],4,0,5.231932997703552 9603,134,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.36487678,ISDB,LZSACGSEJDYUGC-GTKHNMMUSA-N,"InChI=1S/C53H82O16/c1-31-26-43(66-53(28-31)44(56)14-13-39(65-53)29-50(8,59)49(58)61-30-32(2)25-35(5)41(69-60)18-23-54)33(3)11-12-38-16-21-52(64-38)22-17-42-48(68-52)45(57)37(7)47(63-42)40(55)27-36(6)46-34(4)15-20-51(67-46)19-9-10-24-62-51/h11-12,28,33-34,36,38-48,54-57,59-60H,2,5,7,9-10,13-27,29-30H2,1,3-4,6,8H3/b12-11+/t33-,34-,36+,38+,39+,40+,41+,42-,43+,44-,45-,46+,47+,48-,50-,51+,52-,53-/m1/s1",C=C(COC(=O)[C@](C)(O)C[C@@H]1CC[C@@H](O)[C@]2(C=C(C)C[C@@H]([C@H](C)/C=C/[C@H]3CC[C@@]4(CC[C@H]5O[C@H]([C@@H](O)C[C@H](C)[C@H]6O[C@@]7(CCCCO7)CC[C@H]6C)C(=C)[C@@H](O)[C@@H]5O4)O3)O2)O1)CC(=C)[C@H](CCO)OO,C53H82O16,,974.560286544,LZSACGSEJDYUGC,Polyketides,Polyethers,Polyether ionophores,Prorocentrum lima,5986377.0,['Eukaryota'],['Unknown'],['Ciliophora'],['Colpodea'],['Cyrtolophosidida'],['Unknown'],['Unknown'],['Aristerostoma'],['Prorocentrum lima'],1,1,2.95950710773468 9604,133,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZFMSMUAANRJZFM-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3",C=CCc1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,ZFMSMUAANRJZFM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 9605,133,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,RUVINXPYWBROJD-ONEGZZNKSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+",C/C=C/c1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 9606,132,298,Shikimates and Phenylpropanoids,Diphenyl ethers (DPEs),Fungal DPEs,0.0,MS1_match,XPMOQRHVZJDUKK-SWZHBTMOSA-N,"InChI=1S/C16H24O8/c1-2-9-10-3-4-21-6-8(10)7-22-15(9)24-16-14(20)13(19)12(18)11(5-17)23-16/h2,7,9-20H,1,3-6H2/t9-,10-,11-,12-,13+,14-,15+,16+/m1/s1",C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2COCC[C@H]21,C16H24O8,pos_1_1potassium,344.1471177279999,XPMOQRHVZJDUKK,Terpenoids,Monoterpenoids,Secoiridoid monoterpenoids,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,0,7.0 9607,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1dmso,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9608,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1dmso,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9609,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton1dmso,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9610,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1dmso,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9611,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1dmso,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9612,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton1dmso,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9613,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1dmso,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9614,130,70,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton1dmso,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9615,129,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.5871521,ISDB,QDISWXTVLYHRCQ-NJVBHSBISA-N,"InChI=1S/C35H40O10/c1-21(36)41-28-29(44-31(39)24-15-11-8-12-16-24)33(5)26(43-27(38)18-17-23-13-9-7-10-14-23)19-25-20-35(33,45-32(25,3)4)34(6,40)30(28)42-22(2)37/h7-18,25-26,28-30,40H,19-20H2,1-6H3/b18-17-/t25-,26+,28+,29+,30+,33-,34+,35-/m1/s1",CC(=O)O[C@H]1[C@H](OC(=O)c2ccccc2)[C@@]2(C)[C@@H](OC(=O)/C=C\c3ccccc3)C[C@@H]3C[C@]2(OC3(C)C)[C@@](C)(O)[C@H]1OC(C)=O,C35H40O10,,620.26214748,QDISWXTVLYHRCQ,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Maytenus jelskii,6092967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Maytenus'],['Maytenus jelskii'],6,2,9.348608493804932 9616,128,916,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.27099,ISDB,DKVQOAMBVKKPAM-MDZDMXLPSA-N,"InChI=1S/C13H16O/c1-4-13(2,3)10-9-11-5-7-12(14)8-6-11/h4-10,14H,1H2,2-3H3/b10-9+",C=CC(C)(C)/C=C/c1ccc(O)cc1,C13H16O,,188.120115132,DKVQOAMBVKKPAM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cullen corylifolia,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.583960056304932 9617,128,916,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.27099,ISDB,DKVQOAMBVKKPAM-MDZDMXLPSA-N,"InChI=1S/C13H16O/c1-4-13(2,3)10-9-11-5-7-12(14)8-6-11/h4-10,14H,1H2,2-3H3/b10-9+",C=CC(C)(C)/C=C/c1ccc(O)cc1,C13H16O,,188.120115132,DKVQOAMBVKKPAM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Cullen corylifolium,541330.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Psoraleeae'],['Cullen'],['Cullen corylifolium'],4,3,6.583960056304932 9618,127,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.81806725,ISDB,HXQHFNIKBKZGRP-UHFFFAOYSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)",CCCCCC=CCC=CCCC=CCCCC(=O)O,C18H30O2,,278.2245802,HXQHFNIKBKZGRP,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Teucrium cubense,3882648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Teucrium'],['Teucrium cubense'],4,3,8.772269010543823 9619,127,454,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,0.81806725,ISDB,HXQHFNIKBKZGRP-UHFFFAOYSA-N,"InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)",CCCCCC=CCC=CCCC=CCCCC(=O)O,C18H30O2,,278.2245802,HXQHFNIKBKZGRP,Fatty acids,Fatty Acids and Conjugates,Unsaturated fatty acids,Teucrium depressum,3882648.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Teucrium'],['Teucrium cubense'],4,3,8.772269010543823 9620,126,594,,,,0.61797965,ISDB,,,,,,,WFDXOXNFNRHQEC,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,2.4719185829162598 9621,125,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.4101029,ISDB,NGOSGEYHKQYUTN-XIBKBKGSSA-N,"InChI=1S/C48H84N2O17/c1-18-34-48(13,58)41(56)25(4)37(53)23(2)21-46(11,67-35-20-33(50(16)17)38(54)28(7)60-35)42(65-45-39(55)32(49(14)15)19-24(3)59-45)26(5)40(27(6)44(57)63-34)64-36-22-47(12,66-31(10)52)43(29(8)61-36)62-30(9)51/h23-29,32-36,38-43,45,54-56,58H,18-22H2,1-17H3/t23-,24-,25+,26+,27-,28+,29+,32+,33-,34-,35+,36+,38+,39-,40+,41-,42-,43+,45+,46-,47-,48-/m1/s1",CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC(C)=O)[C@@H](OC(C)=O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(O[C@H]2C[C@@H](N(C)C)[C@@H](O)[C@H](C)O2)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O,C48H84N2O17,,960.576999228,NGOSGEYHKQYUTN,Polyketides,Macrolides,Erythromycins,Micromonospora megalomicea,75928.0,['Bacteria'],['Unknown'],['Actinobacteria'],['Unknown'],['Streptomycetales'],['Streptomycetaceae'],['Unknown'],['Streptomyces'],['Micromonospora megalomicea'],0,1,2.140411615371704 9622,122,-1,,,,0.33430687,ISDB,FGPOGAUCGOZVPS-XBLVEGMJSA-N,"InChI=1S/C18H26O/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(19)16-14-17/h7-10,13-16,19H,2-6,11-12H2,1H3/b8-7+,10-9+",CCCCCC/C=C/C=C/CCc1ccc(O)cc1,C18H26O,,258.198365452,FGPOGAUCGOZVPS,Polyketides,Aromatic polyketides,Catechols with side chains,Piper villiramulum,865488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Piperales'],['Piperaceae'],['Unknown'],['Piper'],['Piper villiramulum'],4,0,5.337227463722229 9623,121,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9624,121,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9625,121,-1,,,,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9626,121,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_sodium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9627,121,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_sodium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9628,121,-1,,,,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_sodium,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9629,121,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9630,121,-1,,,,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_sodium,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,0,8.0 9631,121,-1,,,,0.0,MS1_match,NEVMWOQJRSZYIC-UUANRDTJSA-N,"InChI=1S/C30H36O18/c1-39-13-5-11-6-14(40-2)25(13)47-29-23(35)21(33)19(31)17(45-29)10-44-28(38)12-7-15(41-3)26(16(8-12)42-4)48-30-24(36)22(34)20(32)18(46-30)9-43-27(11)37/h5-8,17-24,29-36H,9-10H2,1-4H3/t17-,18-,19-,20-,21+,22+,23-,24-,29+,30+/m1/s1",COc1cc2cc(OC)c1O[C@@H]1O[C@H](COC(=O)c3cc(OC)c(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O,C30H36O18,pos_2_2sodium,684.190164312,NEVMWOQJRSZYIC,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Simple phenolic acids,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 9632,120,1287,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_1proton,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],9,3,10.5 9633,120,1287,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,IKGXIBQEEMLURG-NVPNHPEKSA-N,"InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O16,pos_1_1proton,610.15338488,IKGXIBQEEMLURG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],9,3,10.5 9634,117,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,BSOROLZKYXGRJC-LVXXQJFHSA-N,"InChI=1S/C23H34N2O3/c1-4-21-10-16(28-3)23-13-8-12-6-7-22(27,18(13)17(12)20(24)26)14(9-15(21)23)19(23)25(5-2)11-21/h4,12-19,27H,1,5-11H2,2-3H3,(H2,24,26)/t12?,13?,14?,15?,16-,17?,18?,19?,21+,22-,23?/m0/s1",C=C[C@]12C[C@H](OC)C34C5CC6CC[C@](O)(C(CC31)C4N(CC)C2)C5C6C(N)=O,C23H34N2O3,pos_2MNa,386.256942948,BSOROLZKYXGRJC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 9635,115,269,Shikimates and Phenylpropanoids,Sesquiterpenoids,Simple coumarins,0.48156658,ISDB,ILEDWLMCKZNDJK-UHFFFAOYSA-N,"InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H",O=c1ccc2cc(O)c(O)cc2o1,C9H6O4,,178.026608672,ILEDWLMCKZNDJK,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,3,9.426266312599182 9636,114,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.295003,ISDB,LUHSAQXAWGYFFI-SLVUGFETSA-N,"InChI=1S/C45H38O18/c46-18-10-27(53)34-31(11-18)61-44(17-3-6-23(49)26(52)9-17)41(60)37(34)35-28(54)14-32-36(39(35)58)33(40(59)43(62-32)16-2-5-22(48)25(51)8-16)19-12-29(55)38(57)20-13-30(56)42(63-45(19)20)15-1-4-21(47)24(50)7-15/h1-12,14,30,33,37,40-44,46-60H,13H2/t30-,33+,37-,40-,41-,42-,43-,44-/m1/s1",Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc2c(c1O)[C@H](c1cc(O)c(O)c3c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)C3)[C@@H](O)[C@@H](c1ccc(O)c(O)c1)O2,C45H38O18,,866.205814376,LUHSAQXAWGYFFI,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,Kandelia candel,973786.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Rhizophoraceae'],['Unknown'],['Kandelia'],['Kandelia candel'],4,3,6.680011987686157 9637,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-ZETCQYMHSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1",CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,3,8.748250484466553 9638,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-ZETCQYMHSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1",CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Phaseolus vulgaris,825707.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Phaseolus'],['Phaseolus vulgaris'],4,3,8.748250484466553 9639,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-UHFFFAOYSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)",CC(C)(CO)C(O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Arabidopsis thaliana,309263.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Brassicaceae'],['Camelineae'],['Arabidopsis'],['Arabidopsis thaliana'],4,3,8.748250484466553 9640,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-ZETCQYMHSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1",CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Vicia faba,539544.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Fabeae'],['Vicia'],['Vicia faba'],4,3,8.748250484466553 9641,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-ZETCQYMHSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1",CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Prunus avium,162547.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Amygdaleae'],['Prunus'],['Prunus avium'],4,3,8.748250484466553 9642,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-UHFFFAOYSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)",CC(C)(CO)C(O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Ardisia crenata,776705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia crenata'],4,3,8.748250484466553 9643,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-UHFFFAOYSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)",CC(C)(CO)C(O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Psychotria punctata,171145.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Gentianales'],['Rubiaceae'],['Psychotrieae'],['Psychotria'],['Psychotria punctata'],4,3,8.748250484466553 9644,113,1458,Amino acids and Peptides,Small peptides,Dipeptides,0.8120626,ISDB,GHOKWGTUZJEAQD-ZETCQYMHSA-N,"InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1",CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O,C9H17NO5,,219.110672644,GHOKWGTUZJEAQD,Amino acids and Peptides,Small peptides,Dipeptides,Panax ginseng,524063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Araliaceae'],['Unknown'],['Panax'],['Panax ginseng'],4,3,8.748250484466553 9645,112,298,Shikimates and Phenylpropanoids,Diphenyl ethers (DPEs),Fungal DPEs,0.227303,ISDB,NHFOSXIOFJJQTP-FSDJSFAOSA-N,"InChI=1S/C16H19NO6S/c1-9-13(19)14(20)15(22-10(2)18)16(21-9)23-12-5-3-11(4-6-12)7-17-8-24/h3-6,9,13-16,19-20H,7H2,1-2H3/t9-,13-,14+,15+,16-/m0/s1",CC(=O)O[C@H]1[C@H](Oc2ccc(CN=C=S)cc2)O[C@@H](C)[C@H](O)[C@H]1O,C16H19NO6S,,353.0933083279999,NHFOSXIOFJJQTP,Shikimates and Phenylpropanoids,,,Moringa oleifera,883783.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Brassicales'],['Moringaceae'],['Unknown'],['Moringa'],['Moringa oleifera'],4,1,5.409211993217468 9646,108,-1,,,,0.0,MS1_match,GYHJUGYOSOGTKF-UHFFFAOYSA-N,InChI=1S/C5H6O3/c6-4-1-2-5(7)8-3-4/h1-3H2,O=C1CCC(=O)OC1,C5H6O3,pos_2MK,114.031694052,GYHJUGYOSOGTKF,,,,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,0,6.0 9647,106,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.71412975,ISDB,SPJFYYJXNPEZDW-FTJOPAKQSA-N,"InChI=1S/C26H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h9-10,12-13,25,28H,5-8,11,14-24H2,1-4H3/b10-9-,13-12-/t25-/m1/s1",CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C,C26H50NO7P,,519.3324895699999,SPJFYYJXNPEZDW,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Vitis vinifera,756728.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Vitales'],['Vitaceae'],['Viteae'],['Vitis'],['Vitis vinifera'],4,3,8.356518983840942 9648,106,71,Terpenoids,Glycerophospholipids,Glycerophosphocholines,0.71412975,ISDB,SPJFYYJXNPEZDW-UHFFFAOYSA-N,"InChI=1S/C26H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h9-10,12-13,25,28H,5-8,11,14-24H2,1-4H3",CCCCCC=CCC=CCCCCCCCC(=O)OCC(O)COP(=O)([O-])OCC[N+](C)(C)C,C26H50NO7P,,519.3324895699999,SPJFYYJXNPEZDW,Fatty acids,Glycerophospholipids,Glycerophosphocholines,Nicotiana tabacum,222787.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Solanales'],['Solanaceae'],['Nicotianeae'],['Nicotiana'],['Nicotiana tabacum'],4,3,8.356518983840942 9649,105,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.2077749,ISDB,OBTMNFZFNXQANA-PSRVQCNGSA-N,"InChI=1S/C45H70O10/c1-12-25(3)37(50)54-35-36(55-38(51)26(4)13-2)45(24-52-39-34(49)33(48)29(23-46)53-39)21-20-43(10)27(28(45)22-40(35,5)6)14-15-31-42(9)18-17-32(47)41(7,8)30(42)16-19-44(31,43)11/h12-14,28-36,39,46-49H,15-24H2,1-11H3/b25-12+,26-13+/t28-,29+,30-,31+,32-,33-,34-,35-,36-,39-,42-,43+,44+,45-/m0/s1",C/C=C(\C)C(=O)O[C@H]1[C@H](OC(=O)/C(C)=C/C)[C@]2(CO[C@H]3O[C@H](CO)[C@H](O)[C@@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2CC1(C)C,C45H70O10,,770.49689844,OBTMNFZFNXQANA,Terpenoids,Triterpenoids,Oleanane triterpenoids,Planchonia careya,3901629.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Lecythidaceae'],['Unknown'],['Planchonia'],['Planchonia careya'],4,3,6.331099629402161 9650,102,439,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Agarofuran sesquiterpenoids,0.25785267,ISDB,SGNVKVVRCUBSSV-SNVBAGLBSA-N,"InChI=1S/C11H9NO2/c13-11-9-5-7-3-1-2-4-8(7)6-10(9)12-14-11/h1-5,10,12H,6H2/t10-/m1/s1",O=C1ON[C@@H]2Cc3ccccc3C=C12,C11H9NO2,,187.063328528,SGNVKVVRCUBSSV,Shikimates and Phenylpropanoids,,,Glehnia littoralis,622365.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Glehnia'],['Glehnia littoralis'],4,1,5.5314106941223145 9651,100,109,Terpenoids,Diterpenoids,Estrane steroids,0.4380654,ISDB,MQJPOSCYXGJLPQ-IUOWXXPRSA-N,"InChI=1S/C18H28O3/c1-5-16(19)20-13-14(2)7-6-10-18(4)15-8-11-17(3,21-18)12-9-15/h7-8,11,15H,5-6,9-10,12-13H2,1-4H3/b14-7+/t15-,17+,18-/m0/s1",CCC(=O)OC/C(C)=C/CC[C@]1(C)O[C@]2(C)C=C[C@H]1CC2,C18H28O3,,292.203844756,MQJPOSCYXGJLPQ,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Artemisia sieberi,324847.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Anthemideae'],['Artemisia'],['Artemisia sieberi'],4,1,6.252261638641357 9652,99,-1,,,,0.0,MS1_match,AALXOLVYFZPFPN-NSCUHMNNSA-N,"InChI=1S/C10H14O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-5,8,11-12H,6-7H2,1H3/b3-2+",COC1=C(O)C=CC(/C=C/CO)C1,C10H14O3,pos_2MHCH3CN,182.094294308,AALXOLVYFZPFPN,,,,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 9653,99,-1,,,,0.0,MS1_match,MWOMNLDJNQWJMK-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h4-5,7,11-12H,2-3,6H2,1H3",COc1cc(CCCO)ccc1O,C10H14O3,pos_2MHCH3CN,182.094294308,MWOMNLDJNQWJMK,,,,Aconitum baicalense,1014257.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum baicalense'],6,0,6.0 9654,99,-1,,,,0.0,MS1_match,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,pos_2MHNH3,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 9655,99,-1,,,,0.0,MS1_match,UYGYXBOUYJLANA-CCXSFMJYSA-N,"InChI=1S/C11H14O3/c1-6-4-7(12)5-8-9(13)2-3-10(14)11(6)8/h2-3,5-7,10-12,14H,4H2,1H3/t6-,7-,10-,11+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C=C[C@@H](O)[C@H]21,C11H14O3,pos_2MHNH3,194.094294308,UYGYXBOUYJLANA,Terpenoids,,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,0,6.0 9656,99,-1,,,,0.0,MS1_match,ULRBKGCIGBUVLG-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-5-6-3-8(11)10(2)7(6)4-12-9(5)13-10/h6-9,11H,1,3-4H2,2H3",C=C1C2OCC3C1CC(O)C3(C)O2,C10H14O3,pos_2MHCH3CN,182.094294308,ULRBKGCIGBUVLG,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 9657,99,-1,,,,0.0,MS1_match,IBWYIXZIEIPGJL-UHFFFAOYSA-N,"InChI=1S/C10H14O3/c1-7-5-13-10(6-12)8(4-11)2-3-9(7)10/h2,9,11-12H,1,3-6H2",C=C1COC2(CO)C(CO)=CCC12,C10H14O3,pos_2MHCH3CN,182.094294308,IBWYIXZIEIPGJL,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,Valeriana jatamansi,1035981.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana jatamansi'],6,0,6.0 9658,99,-1,,,,0.0,MS1_match,XSZSWLQVSFTVBN-UHFFFAOYSA-N,"InChI=1S/C22H31NO6/c1-3-23-8-19-13-5-11-17(23)21(13,15(24)6-16(19)29-19)14-4-10-12(26-2)7-20(11)22(14,18(10)25)28-9-27-20/h10-18,24-25H,3-9H2,1-2H3",CCN1CC23OC2CC(O)C24C1C(CC32)C12CC(OC)C3CC4C1(OCO2)C3O,C22H31NO6,pos_1_1proton,405.215137712,XSZSWLQVSFTVBN,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kirinense,5737821.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kirinense'],6,0,6.0 9659,99,-1,,,,0.0,MS1_match,ONKJDAKRKDXIDT-MSBYCJTASA-N,"InChI=1S/C22H31NO6/c1-19-5-4-14(27-3)22-11-6-10-12(26-2)7-20(15(11)16(10)24)21(8-13(19)22,29-9-28-20)17(22)23-18(19)25/h10-17,24H,4-9H2,1-3H3,(H,23,25)/t10?,11-,12?,13-,14+,15-,16+,17-,19-,20-,21?,22-/m1/s1",COC1C[C@]23OCOC24C[C@H]2[C@@]5([C@@H](OC)CC[C@@]2(C)C(=O)N[C@H]45)[C@@H]2CC1[C@H](O)[C@@H]23,C22H31NO6,pos_1_1proton,405.215137712,ONKJDAKRKDXIDT,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium tongolense,176338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium tongolense'],6,0,6.0 9660,99,-1,,,,0.0,MS1_match,AQELCJOMPNYNFK-FRYAJNIMSA-N,"InChI=1S/C22H31NO6/c1-3-23-8-19-13-5-11-17(23)21(13,15(24)6-16(19)29-19)14-4-10-12(26-2)7-20(11,25)22(14)18(10)27-9-28-22/h10-18,24-25H,3-9H2,1-2H3/t10-,11+,12+,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+/m1/s1",CCN1C[C@]23O[C@H]2C[C@H](O)[C@@]24[C@@H]3C[C@@H]([C@@H]12)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@]13OCO[C@H]23,C22H31NO6,pos_1_1proton,405.215137712,AQELCJOMPNYNFK,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum kirinense,5737821.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum kirinense'],6,0,6.0 9661,97,476,Alkaloids,Tyrosine alkaloids,Isoquinoline alkaloids,0.0,MS1_match,GYHJUGYOSOGTKF-UHFFFAOYSA-N,InChI=1S/C5H6O3/c6-4-1-2-5(7)8-3-4/h1-3H2,O=C1CCC(=O)OC1,C5H6O3,pos_2MHNH3,114.031694052,GYHJUGYOSOGTKF,,,,Ranunculus sieboldii,685187.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus sieboldii'],6,0,6.0 9662,94,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.40214586,ISDB,NSOPGAYUGBZWHL-UHFFFAOYSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC=CCC=CCC=CCC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Angelica sinensis,182228.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Apiales'],['Apiaceae'],['Selineae'],['Angelica'],['Angelica sinensis'],4,2,6.608583450317383 9663,94,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.40214586,ISDB,NSOPGAYUGBZWHL-UHFFFAOYSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3",CCC=CCC=CCC=CCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC=CCC=CCC=CCC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Halimodendron halodendron,761641.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Caraganeae'],['Halimodendron'],['Halimodendron halodendron'],4,2,6.608583450317383 9664,94,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.40214586,ISDB,NSOPGAYUGBZWHL-YTWBPVBXSA-N,"InChI=1S/C39H64O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,37,40H,3-4,9-10,15-16,21-36H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C39H64O5,,612.475375148,NSOPGAYUGBZWHL,Fatty acids,Glycerolipids,Triacylglycerols,Glycine max,681762.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Glycine'],['Glycine max'],4,2,6.608583450317383 9665,93,43,Terpenoids,Carotenoids (C40),"Carotenoids (C40, β-β)",0.25699914,ISDB,VLEXYJYNPNSQRM-XRXBZNFBSA-N,"InChI=1S/C36H57NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-34(38)40-27-31(35(2,3)39)30-26-37-32-23-22-28(24-29(30)32)25-33-36(4,5)41-33/h13-14,22-24,26,31,33,37,39H,6-12,15-21,25,27H2,1-5H3/b14-13-/t31-,33+/m1/s1",CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](c1c[nH]c2ccc(C[C@@H]3OC3(C)C)cc12)C(C)(C)O,C36H57NO4,,567.428759304,VLEXYJYNPNSQRM,,,,Hexalobus crispiflorus,6284.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Magnoliales'],['Annonaceae'],['Monodoreae'],['Hexalobus'],['Hexalobus crispiflorus'],4,0,5.02799654006958 9666,89,-1,,,,0.0,MS1_match,KNFOHFRALRKTOJ-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 9667,89,-1,,,,0.0,MS1_match,KNFOHFRALRKTOJ-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc(C[C@@H]2CO[C@@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 9668,89,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 9669,89,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 9670,89,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,0,8.0 9671,89,-1,,,,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_sodium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,0,8.0 9672,87,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,YVBAUDVGOFCUSG-UHFFFAOYSA-N,"InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3",CCCCCc1ccco1,C9H14O,pos_2MH,138.104465068,YVBAUDVGOFCUSG,Polyketides,Cyclic polyketides,Furans,Patrinia villosa,971855.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia villosa'],6,3,7.5 9673,86,212,Fatty acids,Glycerophospholipids,Glycerophosphocholines,0.0,MS1_match,QYVZEPLDLPYECM-UHFFFAOYSA-N,"InChI=1S/C27H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-31-27(30)21-19-24-18-20-25(28)26(29)23-24/h18-21,23,28-29H,2-17,22H2,1H3",CCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(O)c1,C27H44O4,pos_1_1sodium1acetonitrile,432.32395988799993,QYVZEPLDLPYECM,Shikimates and Phenylpropanoids,,,Celastrus hypoleucus,1019456.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus hypoleucus'],6,0,6.0 9674,85,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,JHUMCHQLYHVEBX-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(8-29-21-19(28)18(27)17(26)15(7-22)31-21)3-4-11-12(23)6-14(25)16-13(24)5-10(2)30-20(11)16/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O)cc(O)c2c(=O)cc(C)oc12)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C21H26O10,pos_2_2proton2acetonitrile,438.152597032,JHUMCHQLYHVEBX,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 9675,85,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIPLCTWVYHJTQK-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(7-22)3-4-11-14(6-13(25)16-12(24)5-10(2)29-20(11)16)30-21-19(28)18(27)17(26)15(8-23)31-21/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(C)oc12)CO,C21H26O10,pos_2_2proton2acetonitrile,438.152597032,QIPLCTWVYHJTQK,Polyketides,Chromanes,Chromones,Eranthis hyemalis,756503.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis hyemalis'],6,0,6.0 9676,85,640,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,QIPLCTWVYHJTQK-WORRYRDFSA-N,"InChI=1S/C21H26O10/c1-9(7-22)3-4-11-14(6-13(25)16-12(24)5-10(2)29-20(11)16)30-21-19(28)18(27)17(26)15(8-23)31-21/h3,5-6,15,17-19,21-23,25-28H,4,7-8H2,1-2H3/b9-3+/t15-,17-,18+,19-,21-/m1/s1",C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(C)oc12)CO,C21H26O10,pos_2_2proton2acetonitrile,438.152597032,QIPLCTWVYHJTQK,Polyketides,Chromanes,Chromones,Eranthis cilicica,5922989.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Eranthis'],['Eranthis cilicica'],6,0,6.0 9677,81,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.0,MS1_match,PBLWZMSRSJTRHJ-NCIRKIHRSA-N,"InChI=1S/C32H44O16/c1-42-20-8-14(3-5-18(20)45-31-28(40)26(38)24(36)22(11-34)47-31)7-16-13-44-30(17(16)10-33)15-4-6-19(21(9-15)43-2)46-32-29(41)27(39)25(37)23(12-35)48-32/h3-6,8-9,16-17,22-41H,7,10-13H2,1-2H3/t16-,17-,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C32H44O16,pos_1_1proton1ammonium,684.262935328,PBLWZMSRSJTRHJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,9.0 9678,80,19,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,SFDNWSCFCRWISC-GNMWDIMASA-N,"InChI=1S/C21H36O11/c1-19(2)10-4-5-20(3,32-19)12(6-10)31-17-15(25)14(24)13(23)11(30-17)7-28-18-16(26)21(27,8-22)9-29-18/h10-18,22-27H,4-9H2,1-3H3/t10-,11-,12+,13-,14+,15-,16+,17+,18-,20+,21-/m1/s1",CC1(C)O[C@@]2(C)CC[C@@H]1C[C@@H]2O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C21H36O11,pos_1_sodium,464.225761972,SFDNWSCFCRWISC,Terpenoids,Monoterpenoids,Monocyclic monoterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,2,7.0 9679,78,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_2MNa,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 9680,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9681,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9682,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,WQSDYZZEIBAPIN-VBQORRLJSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C15H18O9,pos_1_1proton,342.0950821559999,WQSDYZZEIBAPIN,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9683,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9684,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9685,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,OHEYCHKLBCPRLZ-VHCZEJTMSA-N,"InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-3-1-7(5-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1",O=C(O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C15H18O9,pos_1_1proton,342.09508215599993,OHEYCHKLBCPRLZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9686,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9687,76,28,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,JVVFTHAOTNXPOZ-SSLCBRODSA-N,"InChI=1S/C15H18O9/c16-8-3-1-7(5-9(8)17)2-4-11(18)23-6-10-12(19)13(20)14(21)15(22)24-10/h1-5,10,12-17,19-22H,6H2/b4-2+/t10-,12-,13+,14-,15?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C15H18O9,pos_1_1proton,342.0950821559999,JVVFTHAOTNXPOZ,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis tashiroi,21287.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis tashiroi'],8,3,9.5 9688,71,439,Shikimates and Phenylpropanoids,Phenolic acids (C6-C1),Agarofuran sesquiterpenoids,0.0,MS1_match,TXQYRZYWFXMOTA-LNDQYQGUSA-N,"InChI=1S/C35H42O8/c1-22-20-28(42-32(38)26-17-11-8-12-18-26)31(41-24(3)37)34(6)29(39-19-13-16-25-14-9-7-10-15-25)21-27-30(40-23(2)36)35(22,34)43-33(27,4)5/h7-18,22,27-31H,19-21H2,1-6H3/b16-13+/t22-,27-,28+,29+,30-,31+,34-,35-/m1/s1",CC(=O)O[C@@H]1[C@H]2C[C@H](OC/C=C/c3ccccc3)[C@]3(C)[C@@H](OC(C)=O)[C@@H](OC(=O)c4ccccc4)C[C@@H](C)[C@@]13OC2(C)C,C35H42O8,pos_3_2proton1sodium,590.287968304,TXQYRZYWFXMOTA,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus orbiculatus,56757.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus orbiculatus'],6,3,7.5 9689,68,-1,,,,0.0,MS1_match,WSXXLLLVOJEZCC-DUHPUZQDSA-N,"InChI=1S/C35H42O16/c1-17(2)29(39)45-16-34-26(47-19(4)37)23(46-18(3)36)13-33(8,42)35(34)27(48-20(5)38)24(32(6,7)51-35)25(49-30(40)21-9-11-43-14-21)28(34)50-31(41)22-10-12-44-15-22/h9-12,14-15,17,23-28,42H,13,16H2,1-8H3/t23-,24+,25+,26-,27+,28-,33-,34-,35-/m0/s1",CC(=O)O[C@H]1C[C@](C)(O)[C@]23OC(C)(C)[C@H]([C@@H](OC(=O)c4ccoc4)[C@H](OC(=O)c4ccoc4)[C@]2(COC(=O)C(C)C)[C@H]1OC(C)=O)[C@H]3OC(C)=O,C35H42O16,pos_2_2proton2acetonitrile,718.247285264,WSXXLLLVOJEZCC,Terpenoids,Sesquiterpenoids,Agarofuran sesquiterpenoids,Celastrus angulatus,709269.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Celastrales'],['Celastraceae'],['Unknown'],['Celastrus'],['Celastrus angulatus'],6,0,6.0 9690,67,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,PRCDDNKVZQBPNG-YBWZTWLNSA-N,"InChI=1S/C18H30O3/c1-11-9-14(20-12(2)19)15-17(11,5)10-13-7-8-18(15,6)21-16(13,3)4/h11,13-15H,7-10H2,1-6H3/t11-,13-,14-,15-,17-,18+/m1/s1",CC(=O)O[C@@H]1C[C@@H](C)[C@@]2(C)C[C@H]3CC[C@](C)(OC3(C)C)[C@H]12,C18H30O3,pos_1_1proton,294.21949482,PRCDDNKVZQBPNG,Terpenoids,Sesquiterpenoids,,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 9691,67,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,GMTBKCJRMNJNFL-UHFFFAOYSA-N,"InChI=1S/C17H26O2/c1-11(10-19-14(4)18)9-15-7-5-12(2)16-8-6-13(3)17(15)16/h9,12,15-16H,5-8,10H2,1-4H3",CC(=O)OCC(C)=CC1CCC(C)C2CCC(C)=C12,C17H26O2,pos_1_1proton1methanol,262.193280072,GMTBKCJRMNJNFL,Terpenoids,Sesquiterpenoids,Valerenane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 9692,67,69,Terpenoids,Sesquiterpenoids,Furans,0.0,MS1_match,BDYQEBZJCFGMCH-PQNDISRJSA-N,"InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)15-8-7-13(2)16(17)10-15/h6-7,15-16H,5,8-11H2,1-4H3/b12-6-/t15-,16-,17+/m0/s1",CC(=O)OC/C(C)=C\CC[C@]1(C)[C@H]2CC=C(C)[C@@H]1C2,C17H26O2,pos_1_1proton1methanol,262.193280072,BDYQEBZJCFGMCH,Terpenoids,Sesquiterpenoids,Bergamotane sesquiterpenoids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 9693,66,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_sodium,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 9694,66,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_sodium,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 9695,63,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.34774187,ISDB,UORRAKMCELTARB-SQKRHONHSA-N,"InChI=1S/C45H68O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29,31,38-39,42-46,49-51H,3-4,9-10,15-16,21-22,27-28,30,32-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC,C45H68O10,,768.4812483759998,UORRAKMCELTARB,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Heterocapsa circularisquama,817277.0,['Eukaryota'],['Unknown'],['Unknown'],['Dinophyceae'],['Peridiniales'],['Unknown'],['Unknown'],['Heterocapsa'],['Heterocapsa circularisquama'],1,0,2.3909674882888794 9696,63,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.34774187,ISDB,UORRAKMCELTARB-CVELTQQQSA-N,"InChI=1S/C45H68O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29,31,38-39,42-46,49-51H,3-4,9-10,15-16,21-22,27-28,30,32-37H2,1-2H3/t38-,39-,42+,43+,44-,45-/m1/s1",CCC=CCC=CCC=CCC=CCC=CCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCC=CCC=CCC=CCC=CCC,C45H68O10,,768.481248376,UORRAKMCELTARB,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Phaeodactylum tricornutum,529438.0,['Eukaryota'],['Unknown'],['Bacillariophyta'],['Bacillariophyceae'],['Unknown'],['Unknown'],['Unknown'],['Phaeodactylum'],['Phaeodactylum tricornutum'],1,0,2.3909674882888794 9697,63,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.34774187,ISDB,UORRAKMCELTARB-DXIJFMLOSA-N,"InChI=1S/C45H68O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29,31,38-39,42-46,49-51H,3-4,9-10,15-16,21-22,27-28,30,32-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-/t38-,39+,42-,43-,44+,45+/m0/s1",CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC(=O)OC[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC,C45H68O10,,768.481248376,UORRAKMCELTARB,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Heterosigma akashiwo,427257.0,['Eukaryota'],['Unknown'],['Unknown'],['Raphidophyceae'],['Unknown'],['Unknown'],['Unknown'],['Heterosigma'],['Heterosigma akashiwo'],1,0,2.3909674882888794 9698,63,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.34774187,ISDB,UORRAKMCELTARB-ZAXHEUPSSA-N,"InChI=1S/C45H68O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29,31,38-39,42-46,49-51H,3-4,9-10,15-16,21-22,27-28,30,32-37H2,1-2H3/b7-5+,8-6+,13-11+,14-12+,19-17+,20-18+,25-23+,26-24+,31-29+/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCC/C=C/C/C=C/C/C=C/C/C=C/CC,C45H68O10,,768.481248376,UORRAKMCELTARB,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Amphidinium,746952.0,['Eukaryota'],['Unknown'],['Unknown'],['Dinophyceae'],['Unknown'],['Unknown'],['Unknown'],['Amphidinium'],['Unknown'],1,0,2.3909674882888794 9699,61,42,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.47405037,ISDB,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,9.396201491355896 9700,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-DPRDWZRASA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16+,17+,18-,19+,20+,21+/m0/s1",OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@H](c2ccc(O)c(O)c2)[C@@H](O)C3)[C@H](O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Hordeum vulgare,657948.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Poales'],['Poaceae'],['Triticeae'],['Hordeum'],['Hordeum vulgare'],4,3,7.648207902908325 9701,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-DPRDWZRASA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16+,17+,18-,19+,20+,21+/m0/s1",OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@H](c2ccc(O)c(O)c2)[C@@H](O)C3)[C@H](O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Fagopyrum esculentum,904381.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Caryophyllales'],['Polygonaceae'],['Fagopyreae'],['Fagopyrum'],['Fagopyrum esculentum'],4,3,7.648207902908325 9702,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-ZZIZYRMTSA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16-,17-,18+,19-,20+,21-/m1/s1",OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@@H](c2ccc(O)c(O)c2)[C@H](O)C3)[C@H](O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Rhaphiolepis indica,316539.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Rosaceae'],['Maleae'],['Rhaphiolepis'],['Rhaphiolepis indica'],4,3,7.648207902908325 9703,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-ZZIZYRMTSA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16-,17-,18+,19-,20+,21-/m1/s1",OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@@H](c2ccc(O)c(O)c2)[C@H](O)C3)[C@H](O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Betula papyrifera,267725.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fagales'],['Betulaceae'],['Unknown'],['Betula'],['Betula papyrifera'],4,3,7.648207902908325 9704,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-RJNJCGSWSA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16?,17+,18-,19?,20+,21+/m0/s1",OCC1O[C@@H](Oc2cc(O)c3c(c2)O[C@H](c2ccc(O)c(O)c2)[C@@H](O)C3)C(O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Ulmus davidiana,4729838.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Rosales'],['Ulmaceae'],['Unknown'],['Ulmus'],['Ulmus davidiana'],4,3,7.648207902908325 9705,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-DPRDWZRASA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16+,17+,18-,19+,20+,21+/m0/s1",OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@H](c2ccc(O)c(O)c2)[C@@H](O)C3)[C@H](O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Vigna angularis,1065959.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Fabales'],['Fabaceae'],['Phaseoleae'],['Vigna'],['Vigna angularis'],4,3,7.648207902908325 9706,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-DPRDWZRASA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16+,17+,18-,19+,20+,21+/m0/s1",OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@H](c2ccc(O)c(O)c2)[C@@H](O)C3)[C@H](O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Excoecaria agallocha,475587.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Hippomaneae'],['Excoecaria'],['Excoecaria agallocha'],4,3,7.648207902908325 9707,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-UHFFFAOYSA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2",OCC1OC(Oc2cc(O)c3c(c2)OC(c2ccc(O)c(O)c2)C(O)C3)C(O)C(O)C1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Borago officinalis,725935.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Boraginales'],['Boraginaceae'],['Boragineae'],['Borago'],['Borago officinalis'],4,3,7.648207902908325 9708,60,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.537052,ISDB,VLFIBROLAXKPQK-RJNJCGSWSA-N,"InChI=1S/C21H24O11/c22-7-16-17(27)18(28)19(29)21(32-16)30-9-4-12(24)10-6-14(26)20(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-5,14,16-29H,6-7H2/t14-,16?,17+,18-,19?,20+,21+/m0/s1",OCC1O[C@@H](Oc2cc(O)c3c(c2)O[C@H](c2ccc(O)c(O)c2)[C@@H](O)C3)C(O)[C@@H](O)[C@@H]1O,C21H24O11,,452.131861588,VLFIBROLAXKPQK,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Paeonia obovata,163406.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Saxifragales'],['Paeoniaceae'],['Unknown'],['Paeonia'],['Paeonia obovata'],4,3,7.648207902908325 9709,56,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.38164487,ISDB,OFKUJHJJCQCWLX-UWVXJICLSA-N,"InChI=1S/C47H72O12/c1-13-25(3)39(53)58-37-38(59-40(54)26(4)14-2)47(24-55-41-36(52)35(51)30(23-48)57-41)29(21-42(37,6)7)28-15-16-32-44(10)19-18-33(50)43(8,9)31(44)17-20-45(32,11)46(28,12)22-34(47)56-27(5)49/h13-15,29-38,41,48,50-52H,16-24H2,1-12H3/b25-13+,26-14+/t29-,30+,31-,32+,33-,34+,35-,36-,37-,38-,41+,44-,45+,46+,47-/m0/s1",C/C=C(\C)C(=O)O[C@H]1[C@H](OC(=O)/C(C)=C/C)[C@]2(CO[C@@H]3O[C@H](CO)[C@H](O)[C@@H]3O)[C@H](OC(C)=O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2CC1(C)C,C47H72O12,,828.502377744,OFKUJHJJCQCWLX,Terpenoids,Triterpenoids,Oleanane triterpenoids,Planchonia careya,3901629.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Lecythidaceae'],['Unknown'],['Planchonia'],['Planchonia careya'],4,3,7.02657949924469 9710,55,691,Terpenoids,Glycerolipids,Monoacylglycerols,0.26488394,ISDB,,,,,,,ZYHCZHIJBQGRNF,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.0595357418060303 9711,54,131,Terpenoids,Sesquiterpenoids,Bufadienolides,0.6588022,ISDB,QRGXNNLNKJPFIX-LBPRGKRZSA-N,"InChI=1S/C12H16O3/c1-9-4-6-11(7-5-9)12(3,14)8-15-10(2)13/h4-7,14H,8H2,1-3H3/t12-/m0/s1",CC(=O)OC[C@](C)(O)c1ccc(C)cc1,C12H16O3,,208.109944372,QRGXNNLNKJPFIX,Terpenoids,Sesquiterpenoids,Bisabolane sesquiterpenoids,Haplopappus remyanus,7599243.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Asterales'],['Asteraceae'],['Astereae'],['Haplopappus'],['Haplopappus remyanus'],4,2,7.63520884513855 9712,50,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.23228326,ISDB,,,,,,,VXLKXBLTTPCBMV,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,0.9291330575942993 9713,48,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.3076373,ISDB,,,,,,,WUHLDGKUYJARLK,,,,,,['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],['Unknown'],0,0,1.2305492162704468 9714,47,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,BSOROLZKYXGRJC-LVXXQJFHSA-N,"InChI=1S/C23H34N2O3/c1-4-21-10-16(28-3)23-13-8-12-6-7-22(27,18(13)17(12)20(24)26)14(9-15(21)23)19(23)25(5-2)11-21/h4,12-19,27H,1,5-11H2,2-3H3,(H2,24,26)/t12?,13?,14?,15?,16-,17?,18?,19?,21+,22-,23?/m0/s1",C=C[C@]12C[C@H](OC)C34C5CC6CC[C@](O)(C(CC31)C4N(CC)C2)C5C6C(N)=O,C23H34N2O3,pos_2MH,386.256942948,BSOROLZKYXGRJC,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Aconitum racemulosum,892121.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum racemulosum'],6,0,6.0 9715,46,53,Shikimates and Phenylpropanoids,Lignans,Neolignans,0.51361793,ISDB,TZAXQHDIMDQXRD-YJQAKTFBSA-N,"InChI=1S/C19H22O5/c1-4-9-18-10-5-6-16(21)19(18,22)24-17(12(18)2)13-7-8-14(20)15(11-13)23-3/h4-8,11-12,17,20,22H,1,9-10H2,2-3H3/t12-,17+,18-,19-/m1/s1",C=CC[C@]12CC=CC(=O)[C@@]1(O)O[C@H](c1ccc(O)c(OC)c1)[C@H]2C,C19H22O5,,330.146723804,TZAXQHDIMDQXRD,Shikimates and Phenylpropanoids,Lignans,Neolignans,Aniba ferrea,6025335.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Laurales'],['Lauraceae'],['Unknown'],['Aniba'],['Aniba ferrea'],4,3,7.554471731185913 9716,45,63,Terpenoids,Small peptides,Secoiridoid monoterpenoids,0.0,MS1_match,ZDXPYRJPNDTMRX-VKHMYHEASA-N,"InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1",NC(=O)CC[C@H](N)C(=O)O,C5H10N2O3,pos_1_1proton,146.06914218,ZDXPYRJPNDTMRX,Amino acids and Peptides,Small peptides,Aminoacids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 9717,45,63,Terpenoids,Small peptides,Secoiridoid monoterpenoids,0.0,MS1_match,MTCFGRXMJLQNBG-REOHCLBHSA-N,"InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1",N[C@@H](CO)C(=O)O,C3H7NO3,pos_1_1proton1acetonitrile,105.042593084,MTCFGRXMJLQNBG,Amino acids and Peptides,Small peptides,Aminoacids,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,2,7.0 9718,42,120,Terpenoids,,,0.0,MS1_match,UCIXTVVKLXHKFA-FXPCSOOLSA-N,"InChI=1S/C24H36O13/c1-10(2)3-4-11-12(7-25)14(35-24-22(33)20(31)18(29)16(9-27)37-24)6-5-13(11)34-23-21(32)19(30)17(28)15(8-26)36-23/h3,5-6,15-33H,4,7-9H2,1-2H3/t15-,16-,17-,18-,19+,20+,21-,22-,23-,24-/m1/s1",CC(C)=CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1CO,C24H36O13,pos_2_1proton1potassium,532.215591212,UCIXTVVKLXHKFA,Terpenoids,,,Clematis terniflora var. mandshurica,446556.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,1,8.5 9719,40,462,Terpenoids,Steroids,Cholestane steroids,0.29922482,ISDB,IWNCBADONFSAAW-NFVQQQKOSA-N,"InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,18-20,22-25,27,31H,7-15,17H2,1-6H3/t19-,20-,22+,23-,24+,25+,27-,28-,29-/m1/s1",CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C,C29H48O2,,428.365430776,IWNCBADONFSAAW,Terpenoids,Steroids,Stigmastane steroids,Patrinia rupestris,1035977.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Patrinia'],['Patrinia rupestris'],6,2,8.19689929485321 9720,39,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_sodium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 9721,39,285,Terpenoids,Triterpenoids,Oleanane triterpenoids,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_sodium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,0,6.0 9722,35,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,RUVINXPYWBROJD-ONEGZZNKSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+",C/C=C/c1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 9723,35,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,RUVINXPYWBROJD-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3",CC=Cc1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,RUVINXPYWBROJD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Valeriana officinalis,393341.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Valeriana'],['Valeriana officinalis'],6,3,7.5 9724,35,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,ZFMSMUAANRJZFM-UHFFFAOYSA-N,"InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3",C=CCc1ccc(OC)cc1,C10H12O,pos_1_1proton1methanol,148.088815004,ZFMSMUAANRJZFM,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Nigella sativa,142360.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Nigelleae'],['Nigella'],['Nigella sativa'],6,3,7.5 9725,33,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,ZTDLEPCPWDWZOM-IOQDTQQCSA-N,"InChI=1S/C30H26O12/c31-16-6-1-14(2-7-16)3-10-23(35)40-13-22-26(36)28(38)29(39)30(42-22)25-19(34)12-21-24(27(25)37)18(33)11-20(41-21)15-4-8-17(32)9-5-15/h1-12,22,26,28-32,34,36-39H,13H2/b10-3+/t22-,26-,28+,29-,30+/m1/s1",O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](c2c(O)cc3oc(-c4ccc(O)cc4)cc(=O)c3c2O)[C@H](O)[C@@H](O)[C@@H]1O,C30H26O12,pos_1_1proton,578.142426272,ZTDLEPCPWDWZOM,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,2,9.0 9726,33,209,Shikimates and Phenylpropanoids,Flavonoids,Proanthocyanins,0.0,MS1_match,UTUISHMYVAZILQ-UHFFFAOYSA-N,"InChI=1S/C30H26O12/c31-14-24-29(42-25(36)10-3-15-1-6-17(32)7-2-15)27(37)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2",O=C(C=Cc1ccc(O)cc1)OC1C(CO)OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)C(O)C1O,C30H26O12,pos_1_1proton,578.142426272,UTUISHMYVAZILQ,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,2,9.0 9727,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 9728,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 9729,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9730,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9731,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 9732,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,0,6.0 9733,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,0,6.0 9734,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9735,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,0,6.0 9736,32,189,Terpenoids,Monoterpenoids,Iridoids monoterpenoids,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_sodium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,0,6.0 9737,31,740,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.42044827,ISDB,WAPGRPJEBCULTQ-UHFFFAOYSA-N,"InChI=1S/C13H20O5/c1-17-13-7-10(3-2-6-14)4-5-12(13)18-11(8-15)9-16/h4-5,7,11,14-16H,2-3,6,8-9H2,1H3",COc1cc(CCCO)ccc1OC(CO)CO,C13H20O5,,256.13107374,WAPGRPJEBCULTQ,Shikimates and Phenylpropanoids,Lignans,Neolignans,Croton lechleri,900868.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Malpighiales'],['Euphorbiaceae'],['Crotoneae'],['Croton'],['Croton lechleri'],4,1,6.1817930936813354 9738,29,-1,,,,0.0,MS1_match,FLCYLPQGSMGINE-UJWYFFHYSA-N,"InChI=1S/C26H43NO6/c1-6-15-21-23(13-28)9-8-18(32-4)25(21)16-10-14-17(31-3)11-24(29,19(16)20(14)33-5)26(15,30)22(25)27(7-2)12-23/h14-22,28-30H,6-13H2,1-5H3/t14-,15+,16-,17+,18+,19-,20+,21-,22+,23+,24-,25+,26-/m1/s1",CC[C@H]1[C@@H]2[C@@]3(CO)CC[C@H](OC)[C@@]24[C@@H]2C[C@H]5[C@H](OC)[C@@H]2[C@](O)(C[C@@H]5OC)[C@]1(O)[C@H]4N(CC)C3,C26H43NO6,pos_2_2proton1ammonium,465.3090380959999,FLCYLPQGSMGINE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium crispulum,309502.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium crispulum'],6,0,6.0 9739,29,-1,,,,0.0,MS1_match,FLCYLPQGSMGINE-UJWYFFHYSA-N,"InChI=1S/C26H43NO6/c1-6-15-21-23(13-28)9-8-18(32-4)25(21)16-10-14-17(31-3)11-24(29,19(16)20(14)33-5)26(15,30)22(25)27(7-2)12-23/h14-22,28-30H,6-13H2,1-5H3/t14-,15+,16-,17+,18+,19-,20+,21-,22+,23+,24-,25+,26-/m1/s1",CC[C@H]1[C@@H]2[C@@]3(CO)CC[C@H](OC)[C@@]24[C@@H]2C[C@H]5[C@H](OC)[C@@H]2[C@](O)(C[C@@H]5OC)[C@]1(O)[C@H]4N(CC)C3,C26H43NO6,pos_2_2proton1ammonium,465.3090380959999,FLCYLPQGSMGINE,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium linearilobum,7591246.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium linearilobum'],6,0,6.0 9740,29,-1,,,,0.0,MS1_match,ORBNFGSLPINTIF-QPVXARCPSA-N,"InChI=1S/C26H43NO6/c1-7-27-12-24(13-28)9-8-17(30-3)26-15-10-14-16(29-2)11-25(33-6,18(15)20(14)31-4)19(23(26)27)21(32-5)22(24)26/h14-23,28H,7-13H2,1-6H3/t14-,15-,16+,17-,18-,19-,20-,21-,22+,23+,24-,25-,26-/m1/s1",CCN1C[C@@]2(CO)CC[C@@H](OC)[C@]34[C@@H]5C[C@H]6[C@@H](OC)[C@@H]5[C@](OC)(C[C@@H]6OC)[C@H]([C@@H](OC)[C@@H]23)[C@H]14,C26H43NO6,pos_2_2proton1ammonium,465.309038096,ORBNFGSLPINTIF,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,0,6.0 9741,28,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.77254176,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya paniculata,81668.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya paniculata'],4,3,8.590167045593262 9742,28,164,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,0.77254176,ISDB,DPTUTXWBBUARQB-UHFFFAOYSA-N,"InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H",O=c1ccc2cccc(O)c2o1,C9H6O3,,162.031694052,DPTUTXWBBUARQB,Shikimates and Phenylpropanoids,Coumarins,Simple coumarins,Murraya exotica,755734.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Sapindales'],['Rutaceae'],['Unknown'],['Murraya'],['Murraya exotica'],4,3,8.590167045593262 9743,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 9744,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9745,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9746,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 9747,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera fulvotomentosa,650610.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera fulvotomentosa'],7,3,8.5 9748,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 9749,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 9750,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 9751,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera dasystyla,960340.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera dasystyla'],7,3,8.5 9752,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera confusa,594829.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera confusa'],7,3,8.5 9753,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 9754,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera macrantha,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9755,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 9756,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-JUHZACGLSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera implexa,692207.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera implexa'],7,3,8.5 9757,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera similis,960338.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera similis'],7,3,8.5 9758,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9759,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9760,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-PNQZTZQXSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m0/s1",O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](O)[C@H]1O,C16H18O9,pos_1_1proton,354.0950821559999,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,3,8.5 9761,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,GWTUHAXUUFROTF-AVXJPILUSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m1/s1",O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@@H](O)C(O)[C@H](O)C1,C16H18O9,pos_1_1proton,354.0950821559999,GWTUHAXUUFROTF,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9762,27,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,CWVRJTMFETXNAD-UHFFFAOYSA-N,"InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)",O=C(C=Cc1ccc(O)c(O)c1)OC1CC(O)(C(=O)O)CC(O)C1O,C16H18O9,pos_1_1proton,354.095082156,CWVRJTMFETXNAD,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera hypoglauca,235196.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera hypoglauca'],7,3,8.5 9763,26,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.42673105,ISDB,MAIRBOUIUZTTQK-UHFFFAOYSA-N,"InChI=1S/C39H62O5/c1-4-6-8-10-12-14-16-18-20-22-24-26-31-28-32(40)29-34(41)37(31)38-33(39(43)36(44-3)30-35(38)42)27-25-23-21-19-17-15-13-11-9-7-5-2/h28-30,40-41H,4-27H2,1-3H3",CCCCCCCCCCCCCC1=C(c2c(O)cc(O)cc2CCCCCCCCCCCCC)C(=O)C=C(OC)C1=O,C39H62O5,,610.459725084,MAIRBOUIUZTTQK,Polyketides,Aromatic polyketides,Catechols with side chains,Ardisia brevicaulis,223967.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Primulaceae'],['Unknown'],['Ardisia'],['Ardisia brevicaulis'],4,1,6.206924200057983 9764,25,-1,,,,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_2MK,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 9765,22,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.6012038,ISDB,BDUAKLHVCJVMNM-UHFFFAOYSA-N,"InChI=1S/C36H38N4O5/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)44-7)33(39-25)31-32(36(43)45-8)35(42)30-19(6)26(40-34(30)31)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,32,37-38H,1,10-12H2,2-8H3",C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[nH]2)c(C)c6CC)C(C)=C5C(=O)C4C(=O)OC)C(CCC(=O)OC)C3C,C36H38N4O5,,606.2842203160001,BDUAKLHVCJVMNM,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Clerodendrum cyrtophyllum,886107.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum cyrtophyllum'],4,3,7.904815196990967 9766,22,73,Terpenoids,Sesquiterpenoids,Carbazole alkaloids,0.6012038,ISDB,BDUAKLHVCJVMNM-UHFFFAOYSA-N,"InChI=1S/C36H38N4O5/c1-9-20-16(3)23-13-25-18(5)22(11-12-29(41)44-7)33(39-25)31-32(36(43)45-8)35(42)30-19(6)26(40-34(30)31)15-28-21(10-2)17(4)24(38-28)14-27(20)37-23/h9,13-15,18,22,32,37-38H,1,10-12H2,2-8H3",C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[nH]2)c(C)c6CC)C(C)=C5C(=O)C4C(=O)OC)C(CCC(=O)OC)C3C,C36H38N4O5,,606.2842203160001,BDUAKLHVCJVMNM,Alkaloids,Tryptophan alkaloids,Carbazole alkaloids,Clerodendrum calamitosum,6086132.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Lamiales'],['Lamiaceae'],['Unknown'],['Clerodendrum'],['Clerodendrum calamitosum'],4,3,7.904815196990967 9767,21,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_1proton1ammonium,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 9768,21,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,KDYAPQVYJXUQNY-OPHDRXFHSA-N,"InChI=1S/C51H84O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-42(53)61-36-39(64-43(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-62-50-49(60)47(58)45(56)41(66-50)38-63-51-48(59)46(57)44(55)40(35-52)65-51/h5-8,11-14,17-20,39-41,44-52,55-60H,3-4,9-10,15-16,21-38H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t39-,40-,41-,44+,45+,46+,47+,48-,49-,50-,51+/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C51H84O15,pos_1_1proton1ammonium,936.5810219880002,KDYAPQVYJXUQNY,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 9769,19,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,KNFOHFRALRKTOJ-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc(C[C@H]2CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_1proton1ammonium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,9.0 9770,19,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,KNFOHFRALRKTOJ-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-8-13(3-5-17(19)29)7-15-12-35-25(16(15)10-27)14-4-6-18(20(9-14)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc(C[C@@H]2CO[C@@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_1proton1ammonium,522.2101119079998,KNFOHFRALRKTOJ,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,9.0 9771,19,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_1proton1ammonium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,9.0 9772,19,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_1proton1ammonium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,9.0 9773,19,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,GAYKAIAESJROGN-SAOYRWCPSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21+,22+,23-,24+,25+,26+/m0/s1",COc1cc([C@H]2OC[C@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO)ccc1O,C26H34O11,pos_1_1proton1ammonium,522.2101119079998,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis stans,21283.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis stans'],8,2,9.0 9774,19,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.0,MS1_match,GAYKAIAESJROGN-DTIHIKGDSA-N,"InChI=1S/C26H34O11/c1-33-19-9-14(4-5-17(19)29)25-16(10-27)15(12-35-25)7-13-3-6-18(20(8-13)34-2)36-26-24(32)23(31)22(30)21(11-28)37-26/h3-6,8-9,15-16,21-32H,7,10-12H2,1-2H3/t15-,16-,21-,22-,23+,24-,25+,26-/m1/s1",COc1cc([C@@H]2OC[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2CO)ccc1O,C26H34O11,pos_1_1proton1ammonium,522.210111908,GAYKAIAESJROGN,Shikimates and Phenylpropanoids,Lignans,Furanoid lignans,Clematis hexapetala,226633.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis hexapetala'],8,2,9.0 9775,18,76,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,0.0,MS1_match,RTATXGUCZHCSNG-QHWHWDPRSA-N,"InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1",C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C27H30O15,pos_1_1proton,594.15847026,RTATXGUCZHCSNG,Shikimates and Phenylpropanoids,Flavonoids,Flavonols,Clematis terniflora,21289.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis terniflora'],8,3,9.5 9776,17,-1,,,,0.0,MS1_match,CDAISMWEOUEBRE-GPIVLXJGSA-N,"InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-",O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O,C6H12O6,pos_1_sodium,180.063388104,CDAISMWEOUEBRE,Carbohydrates,Polyols,Cyclitols,Lonicera bournei,5746380.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera bournei'],7,0,7.0 9777,16,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.63862497,ISDB,ODBRNZZJSYPIDI-VJXVFPJBSA-N,"InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O11,,448.10056145999977,ODBRNZZJSYPIDI,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Clematis rehderiana,289952.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis rehderiana'],8,3,12.054499864578247 9778,13,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-DUXPYHPUSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+",O=C(O)/C=C/c1ccc(O)c(O)c1,C9H8O4,pos_1_1proton,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis vitalba,756499.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis vitalba'],8,3,9.5 9779,13,20,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,QAIPRVGONGVQAS-UHFFFAOYSA-N,"InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)",O=C(O)C=Cc1ccc(O)c(O)c1,C9H8O4,pos_1_1proton,180.042258736,QAIPRVGONGVQAS,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Clematis delavayi,72769.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis delavayi'],8,3,9.5 9780,12,274,Shikimates and Phenylpropanoids,Lignans,Naphthalenes and derivatives,0.5651081,ISDB,VQTFXJZYQVWHJA-UHFFFAOYSA-N,"InChI=1S/C13H14O3/c1-8-6-9-4-5-10(14)13(16-3)12(9)11(7-8)15-2/h4-7,14H,1-3H3",COc1cc(C)cc2ccc(O)c(OC)c12,C13H14O3,,218.094294308,VQTFXJZYQVWHJA,Polyketides,Naphthalenes,Naphthalenes and derivatives,Diospyros celebica,1256.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ericales'],['Ebenaceae'],['Unknown'],['Diospyros'],['Diospyros celebica'],4,3,7.760432481765747 9781,10,600,Alkaloids,Pseudoalkaloids,Terpenoid alkaloids,0.0,MS1_match,TYWXNGXVSZRXNA-NVZSGMJQSA-N,"InChI=1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1",O=C1C=C[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1,C11H16O8,pos_2MHNH3,276.084517472,TYWXNGXVSZRXNA,,,,Clematis ligusticifolia,964063.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Anemoneae'],['Clematis'],['Clematis ligusticifolia'],8,0,8.0 9782,8,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,MLIXRKUBDYCIFK-HQJQHLMTSA-N,"InChI=1S/C11H14O3/c1-7-4-3-5-8-10(13)14-9(12)6-11(7,8)2/h5,7H,3-4,6H2,1-2H3/t7-,11+/m1/s1",C[C@@H]1CCC=C2C(=O)OC(=O)C[C@]21C,C11H14O3,pos_1_1proton1methanol,194.094294308,MLIXRKUBDYCIFK,Terpenoids,Sesquiterpenoids,Eremophilane sesquiterpenoids,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 9783,8,1,Terpenoids,Monoterpenoids,Cinnamic acids and derivatives,0.0,MS1_match,UYGYXBOUYJLANA-CCXSFMJYSA-N,"InChI=1S/C11H14O3/c1-6-4-7(12)5-8-9(13)2-3-10(14)11(6)8/h2-3,5-7,10-12,14H,4H2,1H3/t6-,7-,10-,11+/m1/s1",C[C@@H]1C[C@@H](O)C=C2C(=O)C=C[C@@H](O)[C@H]21,C11H14O3,pos_1_1proton1methanol,194.094294308,UYGYXBOUYJLANA,Terpenoids,,,Nardostachys jatamansi,24101.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Nardostachys'],['Nardostachys jatamansi'],6,1,6.5 9784,7,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6472647,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium andersonii,591156.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Delphinium'],['Delphinium andersonii'],6,3,10.089058876037598 9785,7,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6472647,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium hohenackeri,591154.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitella'],['Aconitella hohenackeri'],6,3,10.089058876037598 9786,7,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6472647,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Consolida ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,10.089058876037598 9787,7,829,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,0.6472647,ISDB,PFTAWBLQPZVEMU-UHFFFAOYSA-N,"InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2",Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2,C15H14O6,,290.07903816799995,PFTAWBLQPZVEMU,Shikimates and Phenylpropanoids,Flavonoids,Flavan-3-ols,Delphinium ajacis,756488.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Consolida'],['Consolida ajacis'],6,3,10.089058876037598 9788,6,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,LREHGXOCZVBABG-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-5-8-6-4-7-9(12-2)10(8)11/h3-4,6-7,11H,1,5H2,2H3",C=CCc1cccc(OC)c1O,C10H12O2,pos_1_1proton1methanol,164.083729624,LREHGXOCZVBABG,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9789,6,132,Terpenoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,0.0,MS1_match,RRAFCDWBNXTKKO-UHFFFAOYSA-N,"InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3",C=CCc1ccc(O)c(OC)c1,C10H12O2,pos_1_1proton1methanol,164.083729624,RRAFCDWBNXTKKO,Shikimates and Phenylpropanoids,Phenylpropanoids (C6-C3),Cinnamic acids and derivatives,Lonicera japonica,2125.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Lonicera'],['Lonicera japonica'],7,3,8.5 9790,5,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.6331482,ISDB,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Thalictrum minus,491705.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum minus'],6,3,10.0325927734375 9791,5,79,Shikimates and Phenylpropanoids,Flavonoids,Flavones,0.6331482,ISDB,MYXNWGACZJSMBT-VJXVFPJBSA-N,"InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1",O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C21H20O10,,432.10564684,MYXNWGACZJSMBT,Shikimates and Phenylpropanoids,Flavonoids,Flavones,Ranunculus repens,310805.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus repens'],6,3,10.0325927734375 9792,4,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1proton1ammonium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 9793,4,26,Polyketides,Glycerolipids,Glycosyldiacylglycerols,0.0,MS1_match,QUZHZFAQJATMCA-QAZQWDDOSA-N,"InChI=1S/C45H74O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,38-39,42-46,49-51H,3-4,9-10,15-16,21-37H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-/t38-,39-,42+,43+,44-,45-/m1/s1",CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC,C45H74O10,pos_1_1proton1ammonium,774.5281985680001,QUZHZFAQJATMCA,Fatty acids,Glycerolipids,Glycosyldiacylglycerols,Ranunculus fluitans,961752.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Ranunculeae'],['Ranunculus'],['Ranunculus fluitans'],6,3,7.5 9794,2,-1,,,,0.0,MS1_match,GLMCNOVFVQRZNZ-RDTXWAMCSA-N,"InChI=1S/C18H16O10/c19-11-4-2-10(3-5-11)16(24)28-14(15(22)23)18(27,17(25)26)8-9-1-6-12(20)13(21)7-9/h1-7,14,19-21,27H,8H2,(H,22,23)(H,25,26)/t14-,18-/m1/s1",O=C(O[C@H](C(=O)O)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O)c1ccc(O)cc1,C18H16O10,pos_2_2sodium,392.0743467119999,GLMCNOVFVQRZNZ,Shikimates and Phenylpropanoids,,,Actaea dahurica,462227.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Cimicifugeae'],['Actaea'],['Actaea dahurica'],6,0,6.0 9795,2,-1,,,,0.0,MS1_match,GZCGUPFRVQAUEE-SLPGGIOYSA-N,"InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m0/s1",O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C6H12O6,pos_1_1potassium,180.063388104,GZCGUPFRVQAUEE,Carbohydrates,Saccharides,Monosaccharides,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 9796,2,-1,,,,0.0,MS1_match,GZCGUPFRVQAUEE-SLPGGIOYSA-N,"InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m0/s1",O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C6H12O6,pos_1_1potassium,180.063388104,GZCGUPFRVQAUEE,Carbohydrates,Saccharides,Monosaccharides,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 9797,2,-1,,,,0.0,MS1_match,WQZGKKKJIJFFOK-GASJEMHNSA-N,"InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1",OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C6H12O6,pos_1_1potassium,180.063388104,WQZGKKKJIJFFOK,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegiifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 9798,2,-1,,,,0.0,MS1_match,WQZGKKKJIJFFOK-GASJEMHNSA-N,"InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1",OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,C6H12O6,pos_1_1potassium,180.063388104,WQZGKKKJIJFFOK,Carbohydrates,Saccharides,Disaccharides,Thalictrum aquilegifolium,815364.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Unknown'],['Thalictrum'],['Thalictrum aquilegiifolium'],6,0,6.0 9799,2,-1,,,,0.0,MS1_match,CDAISMWEOUEBRE-UHFFFAOYSA-N,InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H,OC1C(O)C(O)C(O)C(O)C1O,C6H12O6,pos_1_1potassium,180.063388104,CDAISMWEOUEBRE,Carbohydrates,Polyols,Cyclitols,Aconitum japonicum,5511352.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Ranunculales'],['Ranunculaceae'],['Delphinieae'],['Aconitum'],['Aconitum japonicum'],6,0,6.0 9800,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 9801,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 9802,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 9803,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 9804,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5 9805,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus asper,365911.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus asper'],6,3,7.5 9806,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Dipsacus inermis,776357.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Dipsacus'],['Dipsacus inermis'],6,3,7.5 9807,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria procera,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 9808,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria kotschyi,6061197.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria procera'],6,3,7.5 9809,1,842,Carbohydrates,Saccharides,Disaccharides,0.0,MS1_match,CZMRCDWAGMRECN-UGDNZRGBSA-N,"InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1",OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C12H22O11,pos_1_1potassium,342.116211524,CZMRCDWAGMRECN,Carbohydrates,Saccharides,Disaccharides,Cephalaria nachiczevanica,6061192.0,['Eukaryota'],['Archaeplastida'],['Streptophyta'],['Magnoliopsida'],['Dipsacales'],['Caprifoliaceae'],['Unknown'],['Cephalaria'],['Cephalaria nachiczevanica'],6,3,7.5